matter.farm

Computer-generated molecule database for public drug discovery. About this project.

These compounds may interact with:

Collagenase 3

Potentially involved in: carcinoma; osteoarthritis; degenerative disc disease; rheumatoid arthritis; cancer; synovitis; periodontitis; vascular disease; dental caries; hip dislocation, congenital; liver cirrhosis, experimental; lordosis; degenerative polyarthritis; prostatic neoplasms; curvature of spine; joint stiffness; waddling gait; hip joint varus deformity - observation; metaphyseal chondrodysplasia; short stature

Disease data sourced from Pharos.

Inhibitor

FORMULA:C20H22N2O6S

SMILES: CCNC(=O)c1ccc2oc3cc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)ccc3c2c1

BIRTHDAY: 2018-12-01T14:11:02.799619
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C26H26N2O5

SMILES: CC(C)(C)c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(OCC(=O)O)cc2)cc1

BIRTHDAY: 2018-12-01T14:11:02.809677
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C23H22F6N6O3

SMILES: COc1ccccc1C(=O)Nc1cccc([C@H]2NC[C@H]3C=NN[C@@]3(C(=O)NC(C(F)(F)F)C(F)(F)F)N2)c1

BIRTHDAY: 2018-12-01T14:11:02.822657
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C20H22N2O6S

SMILES: CCNC(=O)c1ccc2c(c1)oc1ccc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)cc12

BIRTHDAY: 2018-12-01T14:11:02.832403
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C17H19FN2O4S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc(-c2cccc(F)c2)c1)C(=O)NO

BIRTHDAY: 2018-12-01T14:11:02.841351
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C24H25N5O6

SMILES: COc1ccccc1C(=O)Nc1ccccc1[C@@H]1CNc2c(C(=O)N[C@@H](CO)C(=O)O)cnn2C1

BIRTHDAY: 2018-12-01T14:11:02.852604
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C25H24N2O5

SMILES: COc1ccc(C(=O)Nc2ccc(C(=O)Nc3ccc(C(C)(C)C(=O)O)cc3)cc2)cc1

BIRTHDAY: 2018-12-01T14:11:02.861799
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C21H27NO4S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc(-c2ccc(C(C)(C)C)cc2)cc1)C(=O)O

BIRTHDAY: 2018-12-01T14:11:02.870090
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis Plan
FORMULA:C15H14N2O4

SMILES: COc1ccccc1C(=O)Nc1ccccc1C(=O)NO

BIRTHDAY: 2018-12-01T14:11:02.878113
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C18H32N4O7

SMILES: CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](NC(=O)[C@H](CC(=O)NO)CC(C)C)C(C)C

BIRTHDAY: 2018-12-01T14:11:02.888717
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1ccccc1C(=O)Nc1ccccc1C(=O)Nc1ccc(C(C)(C)C)cc1

BIRTHDAY: 2018-12-01T14:11:02.897453
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H30N2O2S

SMILES: CC(C)C1=C[C@@H]2C[C@H](C1)CN(Cc1ccc(S(=O)(=O)Nc3ccccc3)cc1)C2

BIRTHDAY: 2018-12-01T14:11:02.905948
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C29H32N6O5

SMILES: COc1ccccc1C(=O)Nc1cccc([C@H]2NC[C@@H]3C=NN[C@@]3(C(=O)N[C@@H](CO)[C@H](O)c3ccccc3)N2)c1

BIRTHDAY: 2018-12-01T14:11:02.918414
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C23H22N2O7S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2oc3ccc(C(=O)NCc4ccco4)cc3c2c1)C(=O)O

BIRTHDAY: 2018-12-01T14:11:02.929524
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C25H34N6O5S2

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c3nc(cc12)CNCCCNCCNC[C@@]1(C)N=C3SC1=O)C(=O)O

BIRTHDAY: 2018-12-25T02:03:06.305064
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H24N2O5

SMILES: COc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccccc2C(C)(C)C(=O)O)c1

BIRTHDAY: 2018-12-25T02:03:06.316837
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)[C@]1(C(=O)N[C@@H](C)C(=O)O)C=CC=C[C@H]1O2)C(=O)O

BIRTHDAY: 2018-12-25T02:03:06.328530
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1cccc(C(=O)Nc2cccc(C(=O)Nc3ccccc3C(C)(C)C)c2)c1

BIRTHDAY: 2018-12-25T02:03:06.337479
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H19FN2O4S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccccc1-c1cccc(F)c1)C(=O)NO

BIRTHDAY: 2018-12-25T02:03:06.346651
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C21H22N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(C(=O)NCCC(=O)O)cc12)C(=O)O

BIRTHDAY: 2018-12-25T02:03:06.357317
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C20H24N2O6S

SMILES: CCNC(=O)[C@@]12C=CC=C[C@H]1Oc1cccc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)c12

BIRTHDAY: 2018-12-25T02:03:06.368181
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1[C@@]1(C(=O)N[C@H](C)C(=O)O)C=CC=C[C@H]1O2)C(=O)O

BIRTHDAY: 2018-12-25T02:03:06.380372
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C20H26N2O4S

SMILES: CC(C)c1ccccc1-c1ccccc1S(=O)(=O)N[C@@H](C(=O)NO)C(C)C

BIRTHDAY: 2018-12-25T02:03:06.389517
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C21H22N2O8S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(C(=O)NCCC(=O)O)cc12)C(=O)O

BIRTHDAY: 2018-12-25T02:03:06.400200
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C21H23NO3

SMILES: CC1(C)[C@@H]2C[C@@H](C(=O)c3ccc(Oc4ccccc4)cc3)CN1CO2

BIRTHDAY: 2018-12-25T02:03:06.408297
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis Plan
FORMULA:C17H20N2O6S

SMILES: COc1cccc(C[C@H](NS(=O)(=O)c2cccc(OC)c2)C(=O)NO)c1

BIRTHDAY: 2018-12-25T02:03:06.419375
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H20N2O6S

SMILES: COc1ccc(C[C@@H](NS(=O)(=O)c2ccc(OC)cc2)C(=O)NO)cc1

BIRTHDAY: 2018-12-25T02:03:06.428752
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C26H30N2O5S

SMILES: CC(C)[C@H](C)NS(=O)(=O)c1ccc2oc3ccc(C(=O)N[C@H]4C=C[C@H]5CC[C@@H](C4)O5)cc3c2c1

BIRTHDAY: 2018-12-25T02:03:06.439586
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C18H25N3O3

SMILES: C[C@H]1C(=O)c2cc(c(C(C)(C)C)nc2N)OCCCOC[C@H]1C#N

BIRTHDAY: 2018-12-25T02:03:06.447838
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C20H22N2O6S

SMILES: CCNC(=O)c1ccc2oc3cc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)ccc3c2c1

BIRTHDAY: 2018-12-25T02:03:06.466909
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C21H22N2O8S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3ccc(C(=O)N[C@@H](C)C(=O)O)cc3c2c1)C(=O)O

BIRTHDAY: 2018-12-03T02:39:09.765049
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C20H16N2O4

SMILES: O=C(Nc1ccccc1C(=O)NO)c1cccc(Oc2ccccc2)c1

BIRTHDAY: 2018-12-03T02:39:09.782896
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1[C@@]1(C(=O)N[C@@H](C)C(=O)O)C=CC=C[C@@H]1O2)C(=O)O

BIRTHDAY: 2018-12-03T02:39:09.795907
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C22H18N2O5

SMILES: COc1ccccc1C(=O)Nc1cccc(C(=O)Nc2ccc(C(=O)O)cc2)c1

BIRTHDAY: 2018-12-03T02:39:09.814647
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H24N2O7S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1cccc2c1O[C@@H]1C=CC=C[C@]21C(=O)NCc1ccoc1)C(=O)O

BIRTHDAY: 2018-12-03T02:39:09.826084
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C21H28N2O4S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1cccc(-c2ccccc2C(C)(C)C)c1)C(=O)NO

BIRTHDAY: 2018-12-03T02:39:09.835063
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C25H30N6O6

SMILES: COc1ccccc1C(=O)Nc1cccc([C@@H]2NC(C)(C)[C@@H]3C=NN[C@]3(C(=O)N[C@H](CO)C(=O)O)N2)c1

BIRTHDAY: 2018-12-03T02:39:09.847199
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C20H24N2O6S

SMILES: CCNC(=O)[C@]12C=CC=C[C@@H]1Oc1cc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)ccc12

BIRTHDAY: 2018-12-03T02:39:09.857591
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C24H22N2O6S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(C(=O)Nc3ccccc3)cc12)C(=O)O

BIRTHDAY: 2018-12-03T02:39:09.867927
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H37N5O4S3

SMILES: CC(C)[C@@H](C)NS(=O)(=O)c1ccc2oc3ccc(-c4sc5nc4C4=N[C@H](CNCCOCCCNC5)CS4)cc3c2c1

BIRTHDAY: 2018-12-03T02:39:09.880869
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H19NO5S

SMILES: COc1ccccc1S(=O)(=O)N[C@@]12C=CC=C[C@@H]1CCC(=O)CO2

BIRTHDAY: 2018-12-03T02:39:09.889785
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1cccc2c1[C@]1(C(=O)N[C@@H](C)C(=O)O)C=CC=C[C@@H]1O2)C(=O)O

BIRTHDAY: 2018-12-03T02:39:09.901847
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C24H27N5O6

SMILES: COc1cccc(C(=O)Nc2cccc([C@]34C=C(C(=O)N[C@H](CO)C(=O)O)NN3CCCN4)c2)c1

BIRTHDAY: 2018-12-03T02:39:09.913097
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C23H22N2O7S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3ccc(C(=O)NCc4ccco4)cc3c2c1)C(=O)O

BIRTHDAY: 2018-12-03T02:39:09.924233
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C20H26N2O4S

SMILES: CC(C)c1cccc(-c2ccccc2S(=O)(=O)N[C@@H](C(=O)NO)C(C)C)c1

BIRTHDAY: 2018-12-03T02:39:09.933137
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C23H24F3N7O4

SMILES: COc1cccc(C(=O)Nc2cccc([C@H]3NC[C@H]4C=NN[C@@]4(C(=O)N[C@@H](C(N)=O)C(F)(F)F)N3)c2)c1

BIRTHDAY: 2018-12-03T02:39:09.945676
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C42H38N10O5

SMILES: COc1ccccc1C(=O)Nc1ccccc1[C@@H]1NC(=O)Nc2n[nH]c(C(=O)Nc3cc4cc(c3)Nc3nccc(n3)-c3cccc(c3)CNCC=CCOC4)c21

BIRTHDAY: 2018-11-30T03:41:06.915094
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C25H31N5O6S2

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3ccc(C(=O)NCCC4=NCSN4)cc3c2c1)[C@@H](O)C(=O)N(C)C

BIRTHDAY: 2018-11-30T03:41:06.927983
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C25H26N2O3

SMILES: COc1ccc(C(=O)Nc2cccc(C(=O)Nc3cccc(C(C)(C)C)c3)c2)cc1

BIRTHDAY: 2018-11-30T03:41:06.936770
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis plan pending
FORMULA:C21H22F3N3O3

SMILES: O=C(NC[C@]1(C(=O)NO)CCCNC1)c1cccc(-c2cccc(C(F)(F)F)c2)c1

BIRTHDAY: 2018-11-30T03:41:06.966301
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis plan pending
FORMULA:C40H40N4O7S2

SMILES: CC(C)[C@@H](NS(=O)(=O)c1cccc2c1O[C@@]1(C(=O)N3CCCCCOc4cccc(c4)Sc4cc(ncn4)-c4cccc(c4)C3)C=CC=C[C@@H]21)C(=O)O

BIRTHDAY: 2018-11-30T03:41:06.982093
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis plan pending
FORMULA:C14H22N6O4S

SMILES: Cc1ncc(NC(=O)[C@]2(N)CCC[C@](C(=O)NO)(C(=O)N(C)C)N2)s1

BIRTHDAY: 2018-11-30T03:41:06.992217
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C21H21F3N2O7S

SMILES: O=C(O)CN1CCC(C(=O)NO)(S(=O)(=O)c2ccc(Oc3ccc(C(F)(F)F)cc3)cc2)CC1

BIRTHDAY: 2018-11-30T03:41:07.004987
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis plan pending
FORMULA:C25H26N2O5S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc(-c2ccc(C(=O)NCc3ccccc3)cc2)cc1)C(=O)O

BIRTHDAY: 2018-11-30T03:41:07.015149
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C20H24N3O7P

SMILES: CNC(=O)[C@@H](CC(=O)NP(=O)(OCc1ccccc1)OCc1ccccc1)C(=O)NO

BIRTHDAY: 2018-11-30T03:41:07.025910
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C23H24N2O7S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)O[C@@H]1C=CC=C[C@]21C(=O)NCc1ccoc1)C(=O)O

BIRTHDAY: 2018-11-30T03:41:07.055790
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis plan pending
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)O[C@H]1C=CC=C[C@]21C(=O)N[C@H](C)C(=O)O)C(=O)O

BIRTHDAY: 2018-11-30T03:41:07.067434
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C25H26N2O3

SMILES: COc1cccc(C(=O)Nc2ccc(C(=O)Nc3ccccc3C(C)(C)C)cc2)c1

BIRTHDAY: 2018-11-30T03:41:07.076239
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1cccc2c1[C@@]1(C(=O)N[C@H](C)C(=O)O)C=CC=C[C@H]1O2)C(=O)O

BIRTHDAY: 2018-11-30T03:41:07.088723
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis plan pending
FORMULA:C24H24N2O6S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC=C[C@@]1(C(=O)Nc1ccccc1)O2)C(=O)O

BIRTHDAY: 2018-11-19T08:15:09.831449
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C29H35N3O4

SMILES: CN(C)C[C@@H](O)COc1ccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)(C)C)cc2)cc1

BIRTHDAY: 2018-11-19T08:15:09.852981
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C20H37N5O6

SMILES: CNC(=O)C(C)(NC(=O)[C@H](NC(=O)[C@H](CC(=O)NO)CC(C)C)C(C)(C)C)C(=O)NC

BIRTHDAY: 2018-11-19T08:15:09.863630
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C30H33N3O4

SMILES: CC(C)c1ccccc1C(=O)N1CCCC[C@@]1(CNC(=O)c1ccccc1-c1ccccc1)C(=O)NO

BIRTHDAY: 2018-11-19T08:15:09.876616
ATC: C09D
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, COMBINATIONS
Synthesis Plan
FORMULA:C22H35N5O5

SMILES: CNC(=O)[C@H](Cc1ccccn1)NC(=O)[C@H](NC(=O)[C@H](CC(=O)NO)CC(C)C)C(C)C

BIRTHDAY: 2018-11-19T08:15:09.907183
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C20H24N2O6S

SMILES: CCNC(=O)[C@@]12C=CC=C[C@H]1Oc1cccc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)c12

BIRTHDAY: 2018-11-19T08:15:09.918697
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H23ClN4O4

SMILES: CN(C)C(=O)C1(C(=O)NO)CCN(CC(=O)Nc2ccc(Cl)cc2)CC1

BIRTHDAY: 2018-11-19T08:15:09.928297
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C27H32ClN5O6

SMILES: CC(C)NC[C@@H](O)[C@@H](O)c1ccc2cc1CCc1cc(ccc1OC[C@H](O)C(=O)O)Nc1ncc(Cl)c(n1)N2

BIRTHDAY: 2018-11-19T08:15:09.941094
ATC: N01B
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, LOCAL
Synthesis Plan
FORMULA:C20H26N2O6S

SMILES: CNC(=O)[C@]12C=CC=C[C@H]1Oc1c2cccc1S(=O)(=O)N[C@H](C(C)C)[C@@H](O)CO

BIRTHDAY: 2018-11-19T08:15:09.951702
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C20H24N2O6S

SMILES: CCNC(=O)[C@]12C=CC=C[C@@H]1Oc1ccc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)cc12

BIRTHDAY: 2018-11-19T08:15:09.962266
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H27N3O6S

SMILES: COc1ccc(S(=O)(=O)N[C@@H](CCCNC(=O)c2ccc(-c3ccccc3)cc2)C(=O)NO)cc1

BIRTHDAY: 2018-11-19T08:15:09.984057
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)(C)C)cc2)c1

BIRTHDAY: 2018-11-19T08:15:09.993383
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H22N2O5

SMILES: CCCCCCNC(=O)c1ccccc1NC(=O)C1=C(O)OC=CO1

BIRTHDAY: 2018-11-19T08:15:10.001875
ATC: S01J
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C24H33N3O5S

SMILES: CCNC(=O)[C@]12C=CC=C[C@H]1c1ccc(S(=O)(=O)N[C@@]3(C(C)C)NCCOC3(C)C)cc1O2

BIRTHDAY: 2018-11-19T08:15:10.022077
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C17H19FN2O4S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1cccc(-c2cccc(F)c2)c1)C(=O)NO

BIRTHDAY: 2018-11-19T08:15:10.030859
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C21H28N2O4S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccccc1-c1ccccc1C(C)(C)C)C(=O)NO

BIRTHDAY: 2018-11-19T08:15:10.039905
ATC: M03B
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS
Synthesis Plan
FORMULA:C21H28N2O4S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccccc1-c1ccccc1C(C)(C)C)C(=O)NO

BIRTHDAY: 2018-11-19T08:15:10.048971
ATC: M03B
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS
Synthesis Plan
FORMULA:C22H35N5O5

SMILES: CNC(=O)[C@H](Cc1ccncc1)NC(=O)[C@H](NC(=O)[C@H](CC(=O)NO)CC(C)C)C(C)C

BIRTHDAY: 2018-11-19T08:15:10.059484
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C21H27NO4S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1cccc(-c2ccccc2C(C)(C)C)c1)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.067855
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H24N2O6S

SMILES: CCNC(=O)[C@@]12C=CC=C[C@H]1Oc1ccc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)cc12

BIRTHDAY: 2018-11-19T08:15:10.078140
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H24N2O6S

SMILES: CCNC(=O)[C@@]12C=CC=C[C@@H]1Oc1c2cccc1S(=O)(=O)N[C@@H](C(=O)O)C(C)C

BIRTHDAY: 2018-11-19T08:15:10.088344
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H25NO4S

SMILES: CC(C)c1ccc(-c2ccc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)cc2)cc1

BIRTHDAY: 2018-11-19T08:15:10.096480
ATC: J01E
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- SULFONAMIDES AND TRIMETHOPRIM
Synthesis Plan
FORMULA:C20H25NO4S

SMILES: CC(C)c1ccc(-c2ccc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)cc2)cc1

BIRTHDAY: 2018-11-19T08:15:10.104533
ATC: J01E
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- SULFONAMIDES AND TRIMETHOPRIM
Synthesis Plan
FORMULA:C18H34N4O5

SMILES: CNC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)NO)CC(C)C)C(C)(C)C

BIRTHDAY: 2018-11-19T08:15:10.114002
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C26H22N2O8

SMILES: O=C(O)c1cccc(-c2ccccc2C(=O)NC[C@H](C(=O)NO)[C@@]23C=C(O)C=CC2=COCC3=O)c1

BIRTHDAY: 2018-11-19T08:15:10.126070
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C23H36N4O6

SMILES: CC(C)C[C@@H](CC(=O)NO)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)NCc1ccc(O)cc1)C(C)C

BIRTHDAY: 2018-11-19T08:15:10.137166
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C21H22F3N3O3

SMILES: O=C(NC[C@]1(C(=O)NO)CCCNC1)c1ccccc1-c1cccc(C(F)(F)F)c1

BIRTHDAY: 2018-11-19T08:15:10.147637
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1O[C@H]1C=CC=C[C@@]21C(=O)N[C@H](C)C(=O)O)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.159062
ATC: V10A
- VARIOUS
- THERAPEUTIC RADIOPHARMACEUTICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C17H20N2O6S

SMILES: COc1ccc(C[C@H](NS(=O)(=O)c2ccc(OC)cc2)C(=O)NO)cc1

BIRTHDAY: 2018-11-19T08:15:10.168277
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)[C@@]1(C(=O)N[C@H](C)C(=O)O)C=CC=C[C@@H]1O2)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.179784
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C25H24N2O6S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(C(=O)NCc3ccccc3)cc12)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.190128
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)[C@@]1(C(=O)N[C@@H](C)C(=O)O)C=CC=C[C@H]1O2)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.221511
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C31H29N3O5

SMILES: CN(CCCOc1ccc(C(=O)Nc2ccccc2C(=O)Nc2cccc(C(=O)O)c2)cc1)c1ccccc1

BIRTHDAY: 2018-11-19T08:15:10.232687
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H24N2O6S

SMILES: CCNC(=O)[C@@]12C=CC=C[C@@H]1Oc1c2cccc1S(=O)(=O)N[C@H](C(=O)O)C(C)C

BIRTHDAY: 2018-11-19T08:15:10.253131
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C14H22N6O4S

SMILES: Cc1ncsc1NC(=O)[C@@]1(N)CC[C@@](C(=O)NO)(C(=O)N(C)C)NC1

BIRTHDAY: 2018-11-19T08:15:10.263083
ATC: G04B
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- UROLOGICALS
Synthesis Plan
FORMULA:C27H35N3O7S

SMILES: CCNC(=O)c1ccc2oc3ccc(S(=O)(=O)N[C@H](C(C)C)[C@H]4CC[C@H]5N[C@@H]4[C@H](O)[C@H](O)[C@@H]5O)cc3c2c1

BIRTHDAY: 2018-11-19T08:15:10.274906
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H28N2O4S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc(-c2ccc(C(C)(C)C)cc2)cc1)C(=O)NO

BIRTHDAY: 2018-11-19T08:15:10.283483
ATC: J02A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOTICS FOR SYSTEMIC USE
- ANTIMYCOTICS FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C28H30N4O6

SMILES: COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CCNC(=O)c1ccc(-c2ccccc2)cc1)C(=O)NO

BIRTHDAY: 2018-11-19T08:15:10.294569
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis Plan
FORMULA:C20H25NO4S

SMILES: CC(C)c1cccc(-c2cccc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)c2)c1

BIRTHDAY: 2018-11-19T08:15:10.302762
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C25H27N3O6S

SMILES: COc1cccc(S(=O)(=O)N[C@@H](C(=O)NO)C(C)(C)NC(=O)c2cccc(-c3ccccc3)c2)c1

BIRTHDAY: 2018-11-19T08:15:10.313392
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1O[C@@H]1C=CC=C[C@]21C(=O)N[C@H](C)C(=O)O)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.325497
ATC: V10A
- VARIOUS
- THERAPEUTIC RADIOPHARMACEUTICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C29H35N3O4

SMILES: CN(C)C[C@@H](O)COc1cccc(C(=O)Nc2ccc(C(=O)Nc3ccccc3C(C)(C)C)cc2)c1

BIRTHDAY: 2018-11-19T08:15:10.335916
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H22N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2oc3ccc(C(=O)NCCC(=O)O)cc3c2c1)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.346721
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C24H25N5O7

SMILES: COc1cccc(C(=O)Nc2cccc([C@@]34C=C(C(=O)NC(C(=O)O)C(=O)O)NN3CCCN4)c2)c1

BIRTHDAY: 2018-11-19T08:15:10.358210
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1[C@@]1(C(=O)N[C@H](C)C(=O)O)C=CC=C[C@@H]1O2)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.369996
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C24H24N2O6S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1cccc2c1[C@@H]1C=CC=C[C@]1(C(=O)Nc1ccccc1)O2)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.388824
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C20H25NO4S

SMILES: CC(C)c1ccccc1-c1cccc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)c1

BIRTHDAY: 2018-11-19T08:15:10.397051
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C27H45N5O5

SMILES: CNC(=O)[C@@]1(C(C)C)COC[C@@H](C(=O)Nc2ccccc2C(=O)NC(C)(C)N(O)C(C)C)CNC1(C)C

BIRTHDAY: 2018-11-19T08:15:10.409292
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C25H33N3O5

SMILES: COc1ccc(C(=O)N[C@H](C(=O)Nc2cccc(C(C)(C)C)c2)C(C)(C)C)c(C(=O)NO)c1

BIRTHDAY: 2018-11-19T08:15:10.418887
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C34H34N4O6

SMILES: C[C@@H](NC(=O)c1ccccc1-c1ccccc1)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)NO

BIRTHDAY: 2018-11-19T08:15:10.434299
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C20H22N2O6S

SMILES: CCNC(=O)c1ccc2oc3ccc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)cc3c2c1

BIRTHDAY: 2018-11-19T08:15:10.443795
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C17H19FN2O4S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccccc1-c1cccc(F)c1)C(=O)NO

BIRTHDAY: 2018-11-19T08:15:10.463591
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C20H22N2O6S

SMILES: CCNC(=O)c1ccc2c(c1)oc1cc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)ccc12

BIRTHDAY: 2018-11-19T08:15:10.472976
ATC: C05A
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- AGENTS FOR TREATMENT OF HEMORRHOIDS AND ANAL FISSURES FOR TOPICAL USE
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1cccc2c1O[C@@H]1C=CC=C[C@]21C(=O)N[C@@H](C)C(=O)O)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.484232
ATC: V10A
- VARIOUS
- THERAPEUTIC RADIOPHARMACEUTICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C21H23N3O5

SMILES: O=C(NC[C@]1(C(=O)NO)CCCNC1)c1ccc(-c2ccccc2C(=O)O)cc1

BIRTHDAY: 2018-11-19T08:15:10.493714
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C20H24N2O6S

SMILES: CCNC(=O)[C@@]12C=CC=C[C@@H]1Oc1cccc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)c12

BIRTHDAY: 2018-11-19T08:15:10.504257
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H20F3N3O6

SMILES: CC(C)[C@@H](CO)[C@@H](c1ccccc1-n1[nH]c(=O)c2c1OC(C(=O)NO)=CO2)C(F)(F)F

BIRTHDAY: 2018-11-19T08:15:10.516252
ATC: A02A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- ANTACIDS
Synthesis Plan
FORMULA:C27H30N4O3

SMILES: CC(C)(C(=O)O)[C@@]1(C)C=CCCOc2cccc(c2)-c2ccnc(n2)Nc2cccc(c2)CN1

BIRTHDAY: 2018-11-19T08:15:10.526341
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C20H24N2O6S

SMILES: CCNC(=O)[C@]12C=CC=C[C@@H]1Oc1cccc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)c12

BIRTHDAY: 2018-11-19T08:15:10.536817
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H25N5O7

SMILES: COc1cccc(C(=O)Nc2cccc([C@]34NCCCN3NC=C4C(=O)NC(C(=O)O)C(=O)O)c2)c1

BIRTHDAY: 2018-11-19T08:15:10.550374
ATC: D05A
- DERMATOLOGICALS
- ANTIPSORIATICS
- ANTIPSORIATICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C28H30N2O5

SMILES: CC(C)(C)c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(OCCCC(=O)O)cc2)cc1

BIRTHDAY: 2018-11-19T08:15:10.570235
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C39H43N3O5

SMILES: COc1ccccc1C(=O)Nc1ccc(C(=O)Nc2ccc([C@@H]3CCCCOCCCc4ccc(cc4)NC(=O)CCC3)cc2)cc1

BIRTHDAY: 2018-11-19T08:15:10.582498
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C28H30N4O6

SMILES: COC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](CCNC(=O)c1ccc(-c2ccccc2)cc1)C(=O)NO

BIRTHDAY: 2018-11-19T08:15:10.593640
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis Plan
FORMULA:C16H27N3O4S2

SMILES: CC(C)[C@H](NS(=O)(=O)[C@@]12C=CC=C[C@H]1CCSC(C)(C)N2)C(=O)NO

BIRTHDAY: 2018-11-19T08:15:10.603092
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H24N2O6S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)O[C@H]1C=CC=C[C@]21C(=O)Nc1ccccc1)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.614256
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H25NO7S2

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3ccc(C4=COCCSCCO4)cc3c2c1)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.624863
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C23H24N2O7S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1O[C@H]1C=CC=C[C@]21C(=O)NCc1ccoc1)C(=O)O

BIRTHDAY: 2018-11-19T08:15:10.646917
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C18H34N4O5

SMILES: CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](CC(=O)NO)CC(C)C)C(C)(C)C

BIRTHDAY: 2018-11-30T17:23:28.712866
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C15H24N6O4S

SMILES: Cc1nc(NC(=O)[C@@]2(N)CCC[C@@](C(=O)NO)(C(=O)N(C)C)N2)c(C)s1

BIRTHDAY: 2018-11-30T17:23:28.723209
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C31H30F3N3O4

SMILES: O=C(NCC1(C(=O)NO)CCN(C(=O)c2ccc(C3(C(F)(F)F)CC3)cc2)CC1)c1ccc(-c2ccccc2)cc1

BIRTHDAY: 2018-11-30T17:23:28.735914
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C17H29NO3

SMILES: CC(C)[C@@H](NC(=O)C1=CCCCCCCCCC1)C(=O)O

BIRTHDAY: 2018-11-30T17:23:28.742957
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C33H51N3O

SMILES: CC(C)[C@@H](NC(=O)[C@@H](C[C@]1(C)CCCCCCCCCCNCCN1)c1ccccc1)c1ccccc1

BIRTHDAY: 2018-11-30T17:23:28.760697
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C18H18Cl2N2O6S

SMILES: O=C(NO)C1(NS(=O)(=O)c2ccc(Oc3ccc(Cl)c(Cl)c3)cc2)CCOCC1

BIRTHDAY: 2018-11-30T17:23:28.796951
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C24H25F4N3O3

SMILES: CC(C)(C)CNC(=O)[C@@H]1CC(c2ccc(F)cc2)=NCN1C(=O)c1ccc(OC(F)(F)F)cc1

BIRTHDAY: 2018-11-30T17:23:28.807736
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C20H25NO4S

SMILES: CC(C)c1ccccc1-c1cccc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)c1

BIRTHDAY: 2018-11-30T17:23:28.816186
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C26H26N2O5

SMILES: CC(C)(C)c1ccccc1NC(=O)c1ccc(NC(=O)c2cccc(OCC(=O)O)c2)cc1

BIRTHDAY: 2018-11-30T17:23:28.836072
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C22H25N3O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)O[C@@]1(C(=O)N[C@@]3(C)NCC(=O)O3)C=CC=C[C@H]21)C(=O)O

BIRTHDAY: 2018-11-30T17:23:28.856921
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C10H16N6O3

SMILES: O=C(NO)C1(CNc2cnnc(=O)[nH]2)CCNCC1

BIRTHDAY: 2018-11-30T17:23:28.874240
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C25H31NO5S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1[C@@H]1C=CC=C[C@@]1(C13CC(CC[C@@H]1C)C3)O2)C(=O)O

BIRTHDAY: 2018-11-30T17:23:28.884317
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C24H22N4O2

SMILES: COc1ccc2c(c1)-c1nc(ccc1C#N)NCC=CCOc1cccc(c1)CN2

BIRTHDAY: 2018-12-02T16:06:36.788106
ATC: A10B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
Synthesis Plan
FORMULA:C17H18N2O5

SMILES: COc1ccc(CNC(=O)c2ccc(C(=O)NO)cc2OC)cc1

BIRTHDAY: 2018-12-02T16:06:36.814296
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C26H26N2O3

SMILES: COc1cccc(C(=O)Nc2cccc(C(=O)Nc3ccccc3C3(C)CCC3)c2)c1

BIRTHDAY: 2018-12-02T16:06:36.832923
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H18N2O5

SMILES: COc1ccccc1C(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)O)cc2)cc1

BIRTHDAY: 2018-12-02T16:06:36.841992
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C26H26N2O5

SMILES: CC(C)(C)c1ccccc1NC(=O)c1cccc(NC(=O)c2cccc(OCC(=O)O)c2)c1

BIRTHDAY: 2018-12-02T16:06:36.851642
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H28N4O8

SMILES: COC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](CNC(=O)c1ccccc1-c1ccccc1C(=O)O)C(=O)NO

BIRTHDAY: 2018-12-02T16:06:36.887410
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C28H31N3O3

SMILES: O=C(NCC1(C(=O)NO)CCN(CCc2ccccc2)CC1)c1ccc(-c2ccccc2)cc1

BIRTHDAY: 2018-12-02T16:06:36.897512
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H19N3O4S

SMILES: COc1ccccc1C(=O)Nc1cccc(C(=O)Nc2ccc(C3=COSN3)cc2)c1

BIRTHDAY: 2018-12-02T16:06:36.907244
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C30H33N5O5

SMILES: COc1ccccc1C(=O)Nc1ccccc1[C@H]1CNCN2NC=C[C@]12C(=O)N[C@H](CO)[C@@H](O)c1ccccc1

BIRTHDAY: 2018-12-02T16:06:36.920756
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis Plan
FORMULA:C15H20ClN5O5

SMILES: N[C@]1(C(=O)Nc2ccccc2Cl)CC[C@](CC(=O)NO)(C(=O)NO)CN1

BIRTHDAY: 2018-12-02T16:06:36.930894
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C15H14N2O

SMILES: C1=NC[C@H](c2ccccc2Oc2ccccc2)N1

BIRTHDAY: 2018-12-02T16:06:36.947249
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C23H28N2O5

SMILES: CC(C)[C@@H](CNC(=O)[C@H]1C=C2C(Oc3ccccc3)=CC=C[C@H]2COC1)C(=O)NO

BIRTHDAY: 2018-12-02T16:06:36.967847
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C23H24N2O7S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1O[C@H]1C=CC=C[C@@]21C(=O)NCc1ccoc1)C(=O)O

BIRTHDAY: 2018-12-03T10:42:58.605605
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C24H22F3N5O5

SMILES: COc1cccc(C(=O)Nc2ccc([C@@H]3CCn4ncc(C(=O)N[C@@H](C(=O)O)C(F)(F)F)c4N3)cc2)c1

BIRTHDAY: 2018-12-03T10:42:58.627300
ATC: C03X
- CARDIOVASCULAR SYSTEM
- DIURETICS
- OTHER DIURETICS
Synthesis Plan
FORMULA:C23H24F3N7O4

SMILES: COc1cccc(C(=O)Nc2cccc([C@@H]3NC[C@@H]4C=NN[C@@]4(C(=O)N[C@H](C(N)=O)C(F)(F)F)N3)c2)c1

BIRTHDAY: 2018-12-03T10:42:58.639971
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)O[C@@H]1C=CC=C[C@]21C(=O)N[C@H](C)C(=O)O)C(=O)O

BIRTHDAY: 2018-12-03T10:42:58.651635
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C24H23N5O7

SMILES: COc1ccccc1C(=O)Nc1ccc([C@H]2CCn3nc(C(=O)NC(C(=O)O)C(=O)O)cc3N2)cc1

BIRTHDAY: 2018-12-03T10:42:58.663364
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C20H24N2O6S

SMILES: CCNC(=O)[C@@]12C=CC=C[C@@H]1Oc1cc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)ccc12

BIRTHDAY: 2018-12-03T10:42:58.713260
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C23H24N2O7S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1[C@@]1(C(=O)NCc3ccoc3)C=CC=C[C@@H]1O2)C(=O)O

BIRTHDAY: 2018-12-03T10:42:58.725321
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C17H15N3O6

SMILES: O=N[C@H](CNC(=O)c1ccc(-c2ccc(C(=O)O)cc2)cc1)C(=O)NO

BIRTHDAY: 2018-12-03T10:42:58.734532
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1[C@]1(C(=O)N[C@@H](C)C(=O)O)C=CC=C[C@@H]1O2)C(=O)O

BIRTHDAY: 2018-12-03T10:42:58.746650
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1cccc2c1O[C@H]1C=CC=C[C@@]21C(=O)N[C@@H](C)C(=O)O)C(=O)O

BIRTHDAY: 2018-12-03T10:42:58.758238
ATC: V10A
- VARIOUS
- THERAPEUTIC RADIOPHARMACEUTICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C18H32N4O7

SMILES: CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](NC(=O)[C@@H](CC(=O)NO)CC(C)C)C(C)C

BIRTHDAY: 2018-12-03T10:42:58.789152
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C31H33F3N2O4

SMILES: CC(C)CNC(=O)[C@@H]1CNCc2ccc(cc2)OCC=CCOc2cccc1c2-c1ccccc1OC(F)(F)F

BIRTHDAY: 2018-12-03T10:42:58.801297
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C21H22N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2oc3ccc(C(=O)N[C@H](C)C(=O)O)cc3c2c1)C(=O)O

BIRTHDAY: 2018-12-03T10:42:58.812337
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis Plan
FORMULA:C9H6FNO3S3

SMILES: O=C(NO)C1=C(Oc2ccc(F)cc2)SSS1

BIRTHDAY: 2018-12-03T19:11:23.728661
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C15H14N2O4

SMILES: COc1cccc(C(=O)Nc2ccccc2C(=O)NO)c1

BIRTHDAY: 2018-12-03T19:11:23.736741
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis Plan
FORMULA:C27H38N4O4S

SMILES: CC(C)C(NS(=O)(=O)c1ccc2oc3ccc(C(=O)N[C@H]4CNCN[C@@H](C)[C@@H]4C)cc3c2c1)C(C)C

BIRTHDAY: 2018-12-03T19:11:23.747844
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H24N2O7S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)[C@@]1(C(=O)NCc3ccoc3)C=CC=C[C@H]1O2)C(=O)O

BIRTHDAY: 2018-12-03T19:11:23.759629
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis Plan
FORMULA:C24H30N4O6S2

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)[C@H]1C=C(C(=O)N[C@@H](C)C(=O)O)C=C[C@H]1O2)[C@@H]1N=NSC1(C)C

BIRTHDAY: 2018-12-03T19:11:23.788997
ATC: J01C
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- BETA-LACTAM ANTIBACTERIALS, PENICILLINS
Synthesis Plan
FORMULA:C23H22N2O7S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)oc1ccc(C(=O)NCc3ccco3)cc12)C(=O)O

BIRTHDAY: 2018-12-03T19:11:23.809259
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C31H51N5O7

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(=O)NO)C(C)C

BIRTHDAY: 2018-12-03T19:11:23.822202
ATC: G03X
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Synthesis Plan
FORMULA:C27H31N3O6S2

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3ccc(C(=O)NCCC4=C[C@@H]5S[C@@H](C4)C[C@@H]5N)cc3c2c1)C(=O)O

BIRTHDAY: 2018-12-03T19:11:23.834372
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C25H24N2O5

SMILES: COc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccc(C(C)(C)C(=O)O)cc3)c2)cc1

BIRTHDAY: 2018-12-01T22:30:28.688184
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H24N2O8S

SMILES: CC(C)[C@H](NS(=O)(=O)c1cccc2c1O[C@H]1C=CC=C[C@]21C(=O)N[C@H](C)C(=O)O)C(=O)O

BIRTHDAY: 2018-12-01T22:30:28.699957
ATC: V10A
- VARIOUS
- THERAPEUTIC RADIOPHARMACEUTICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C28H30N4O6

SMILES: COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCNC(=O)c1ccc(-c2ccccc2)cc1)C(=O)NO

BIRTHDAY: 2018-12-01T22:30:28.711423
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis Plan
FORMULA:C25H26N2O3

SMILES: COc1ccccc1C(=O)Nc1cccc(C(=O)Nc2ccc(C(C)(C)C)cc2)c1

BIRTHDAY: 2018-12-01T22:30:28.741258
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H32N2O6SSi

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC(C(=O)N[C@@H](C)[Si](C)(C)C)=C[C@@H]1O2)C(=O)O

BIRTHDAY: 2018-12-01T22:30:28.751802
ATC: C03A
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, THIAZIDES
Synthesis Plan
FORMULA:C13H18

SMILES: CC1(C)[C@H]2[C@H]3[C@H]4C[C@H]2[C@H]2[C@H]4C[C@H]3[C@H]21

BIRTHDAY: 2018-12-01T22:30:28.757673
ATC: V10A
- VARIOUS
- THERAPEUTIC RADIOPHARMACEUTICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C21H22N2O8S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3ccc(C(=O)NCCC(=O)O)cc3c2c1)C(=O)O

BIRTHDAY: 2018-12-01T22:30:28.768732
ATC: C01D
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- VASODILATORS USED IN CARDIAC DISEASES
Synthesis Plan
FORMULA:C17H20N2O6S

SMILES: COc1ccccc1CN(CC(=O)NO)S(=O)(=O)c1ccccc1OC

BIRTHDAY: 2018-12-01T22:30:28.778914
ATC: C02K
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- OTHER ANTIHYPERTENSIVES
Synthesis Plan
FORMULA:C22H25N5O6S

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)O[C@H]1C=CC=C[C@]21C(=O)N[C@H](C)C(=O)O)[C@H]1C=NN=N1

BIRTHDAY: 2018-12-01T22:30:28.803581
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H37NO5S

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc2oc3ccc(C4(C)CCCCCCCCC4)cc3c2c1)C(=O)O

BIRTHDAY: 2018-12-01T22:30:28.813641
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C30H33N3O4

SMILES: CC(C)c1ccc(C(=O)N2CCC(CNC(=O)c3ccc(-c4ccccc4)cc3)(C(=O)NO)CC2)cc1

BIRTHDAY: 2018-12-01T22:30:28.845242
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C23H37N5O5

SMILES: CNC(=O)[C@H](Cc1ccccn1)NC(=O)[C@H](NC(=O)[C@@H](CC(=O)NO)CC(C)C)C(C)(C)C

BIRTHDAY: 2018-12-01T22:30:28.867722
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan