matter.farm

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

These compounds may interact with:

Phosphatidylinositol 3-kinase regulatory subunit beta

Potentially involved in: carcinoma; polydactyly; syndactyly; influenza; hydrocephalus; blepharoptosis; epilepsy; atrial septal defects; ventricular septal defects; orbital separation excessive; profound mental retardation; kyphosis deformity of spine; microstomia; mitral valve insufficiency; seizures; polydactyly, postaxial; vascular ring; frontal bossing; macrocephaly; muscle degeneration

Disease data sourced from Pharos.

Agonist

FORMULA:C24H27ClN4O3

SMILES: CC(C)(C)C(=O)Nc1ccc(C(=O)N2CCC(n3c(=O)[nH]c4ccc(Cl)cc43)CC2)cc1

BIRTHDAY: 2018-12-01T14:11:31.484029
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C19H35N3O5

SMILES: CC(C)(C)C(=O)N[C@H](C(=O)N1CCCC[C@@]12COC(O)(O)C2)C(C)(C)CN

BIRTHDAY: 2018-12-01T14:11:31.493724
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C17H28N6O2

SMILES: CC(C)C(=O)Nc1n[nH]c2c1N(C(=O)[C@@]1(N)CCCCN1)C(C)(C)C2

BIRTHDAY: 2018-12-01T14:11:31.503312
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis Plan
FORMULA:C42H55N7O5

SMILES: CC(C)(C)NC(=O)c1c2cncc1-c1ccnc(n1)N([C@]13CC[C@@]4(OC(C)(C)N5CCOCC5)[C@H](CCCN41)C3)c1cccc(c1)COCC=CCOC2

BIRTHDAY: 2018-12-01T14:11:31.519306
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C27H31N5O3

SMILES: CNC(=O)c1ccccc1-c1cnc(NC(=O)c2ccccc2C(C)(C)C)nc1N1CCOCC1

BIRTHDAY: 2018-12-01T14:11:31.529820
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12C=CC=C[C@@]1([C@]13NC=CC=C1N=C(C(=O)N1CCOCC1)N3)N=CO2

BIRTHDAY: 2018-12-01T14:11:31.540404
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H39N7O3

SMILES: CC(C)C(=O)N1CCCC[C@@H]1N1C(=O)N[C@]23C=CC=C[C@@]12NN=C3C(=O)N1CCCC[C@]12CCCCN2

BIRTHDAY: 2018-12-01T14:11:31.553963
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C22H32ClN3O4

SMILES: CC(C)(C)C(=O)N[C@H](C(=O)N1CCC[C@@]23C=CC=C(Cl)[C@]12OCC3=O)C(C)(C)CN

BIRTHDAY: 2018-12-01T14:11:31.564003
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12C=CC=C[C@]1([C@@]13NC=CC=C1N=C(C(=O)N1CCOCC1)N3)N=CO2

BIRTHDAY: 2018-12-01T14:11:31.574664
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12C=CC=C([C@@]34N=C(C(=O)N5CCOCC5)NC3=CC=CN4)[C@H]1OC=N2

BIRTHDAY: 2018-12-01T14:11:31.616730
ATC: S01L
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OCULAR VASCULAR DISORDER AGENTS
Synthesis Plan
FORMULA:C18H29N5O2

SMILES: CC(C)C(=O)Nc1[nH]nc2c1CN(C(=O)C1CCN(C)CC1)C2(C)C

BIRTHDAY: 2018-12-25T02:03:34.316666
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C24H30N6O2

SMILES: CC(C)C(=O)N1CCCC[C@H]1N1C(=O)N[C@]23C=CC=C[C@]12C=NN3c1ccccc1CN

BIRTHDAY: 2018-12-25T02:03:34.339271
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C22H33N5O2

SMILES: CC(C)(C)C(=O)N1CCC(n2c(=O)[nH]c3ccc(N4CCC[C@H](N)C4)cc32)CC1

BIRTHDAY: 2018-12-25T02:03:34.348852
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C22H31N3O6

SMILES: CC(C)(C)C(=O)N[C@@H](C(=O)O)C(=O)Nc1ncc2cc1OCCCOCCCCC=C2

BIRTHDAY: 2018-12-25T02:03:34.358833
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C32H29N9O2

SMILES: N[C@@]12C=CC=C[C@@]1([C@]13N=C([C@@H]4Nc5ccnc(n5)Nc5cccc(c5)CCOc5cccc4c5)NC1=CC=CN3)N=CO2

BIRTHDAY: 2018-12-25T02:03:34.395326
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@H]1C=CC=C2[C@]12NC=CC=C1N=C(C(=O)N1CCOCC1)N2

BIRTHDAY: 2018-12-25T02:03:34.406588
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:C19H24N6O3

SMILES: CC(C)(C)C(=O)N1CCC(n2c(=O)[nH]c3cc4[nH]nc(C(N)=O)c4cc32)CC1

BIRTHDAY: 2018-12-25T02:03:34.416558
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C20H36N6O5

SMILES: CC(C)(C)C(=O)NC1(C(=O)N[C@H](CCCNC(=N)N)C(=O)NCC(=O)O)CCCCC1

BIRTHDAY: 2018-12-25T02:03:34.427130
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12OC=N[C@H]1C=CC=C2[C@@]12NC=CC=C1N=C(C(=O)N1CCOCC1)N2

BIRTHDAY: 2018-12-25T02:03:34.438326
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:C14H16N2O2

SMILES: CC(C)(C)c1cccc(-c2ncoc(=O)c2N)c1

BIRTHDAY: 2018-12-25T02:03:34.445280
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis Plan
FORMULA:C17H28N6O2

SMILES: CC(C)C(=O)Nc1n[nH]c2c1CC(C)(C)N2C(=O)[C@@H]1CCN[C@H](N)C1

BIRTHDAY: 2018-12-03T02:39:39.779757
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis Plan
FORMULA:C19H23N5O2

SMILES: CC(C)(C)Nc1nc2cc(-c3ccnc(N4CCOCC4)n3)ccc2o1

BIRTHDAY: 2018-12-03T02:39:39.788715
ATC: A11H
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- OTHER PLAIN VITAMIN PREPARATIONS
Synthesis Plan
FORMULA:C31H35N5O6S

SMILES: O=C(c1ccc(N2CCOCC2)cc1)N1CCC[C@H](n2nc(C(=O)N3CCOCC3)c3c2-c2ccccc2S(=O)(=O)C3)C1

BIRTHDAY: 2018-12-03T02:39:39.802312
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C18H30N6O2

SMILES: CC(C)(C)C(=O)Nc1n[nH]c2c1N(C(=O)[C@]1(N)CCCCN1)C(C)(C)C2

BIRTHDAY: 2018-12-03T02:39:39.812050
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis Plan
FORMULA:C24H23F4N3O3S

SMILES: CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc(-c2ccc(S(C)(=O)=O)cc2F)cnc1N

BIRTHDAY: 2018-12-03T02:39:39.834082
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12C=CC=C[C@]1([C@]13NC=CC=C1N=C(C(=O)N1CCOCC1)N3)N=CO2

BIRTHDAY: 2018-12-03T02:39:39.865961
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C15H20N6O2

SMILES: CC(=O)Nc1c(N2CCOCC2)ncnc1-n1ncc(C)c1C

BIRTHDAY: 2018-12-03T02:39:39.886490
ATC: J01E
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- SULFONAMIDES AND TRIMETHOPRIM
Synthesis Plan
FORMULA:C28H33N7O4

SMILES: COCC(=O)N1CCCC[C@H]1N1[C@@H](N)C(=O)N2C=CC=C3C(c4ccnn4[C@]45C=C[C@@H](CCC4)O5)=CC=N[C@]321

BIRTHDAY: 2018-12-03T02:39:39.900909
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C22H33N5O2

SMILES: CC(C)(C)C(=O)N1CCC(n2c(=O)[nH]c3ccc(N4CCC[C@@H](N)C4)cc32)CC1

BIRTHDAY: 2018-11-30T03:41:35.773283
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C19H33N3O4

SMILES: CC(C)(C)C(=O)N[C@@H](C(=O)N1CCCC[C@@]12OCCC2=O)C(C)(C)CN

BIRTHDAY: 2018-11-30T03:41:35.793080
ATC: D06B
- DERMATOLOGICALS
- ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
- CHEMOTHERAPEUTICS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C24H32Cl2N4O3

SMILES: CC(C)(C)C(=O)N1CCCC[C@H]1N1CC(=O)N[C@]12CCCCN2C(=O)c1cc(Cl)ccc1Cl

BIRTHDAY: 2018-11-30T03:41:35.803635
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis plan pending
FORMULA:C24H21FN4O5

SMILES: O=C(c1ccc(C(=O)N2C=Cn3c(-c4ccc(F)cc4)cnc3C2(O)O)cc1)N1CCOCC1

BIRTHDAY: 2018-11-30T03:41:35.814670
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis plan pending
FORMULA:C17H28N6O2

SMILES: CC(C)C(=O)Nc1n[nH]c2c1N(C(=O)[C@]1(N)CCCCN1)CC2(C)C

BIRTHDAY: 2018-11-30T03:41:35.824046
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis plan pending
FORMULA:C17H28N6O2

SMILES: CC(C)C(=O)Nc1n[nH]c2c1N(C(=O)[C@]1(N)CCCCN1)C(C)(C)C2

BIRTHDAY: 2018-11-30T03:41:35.833500
ATC: B05A
- BLOOD AND BLOOD FORMING ORGANS
- BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
- BLOOD AND RELATED PRODUCTS
Synthesis plan pending
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@H]1C=CC=C2[C@H]1NC=Cc2[nH]c(C(=O)N3CCOCC3)nc21

BIRTHDAY: 2018-11-19T08:15:00.212793
ATC: C03B
- CARDIOVASCULAR SYSTEM
- DIURETICS
- LOW-CEILING DIURETICS, EXCL. THIAZIDES
Synthesis plan pending
FORMULA:C18H27N3OS2

SMILES: CC1(C)SCCS[C@@H]1c1ccccc1C(=O)N[C@@]1(N)CCCCN1

BIRTHDAY: 2018-11-19T08:15:00.231167
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis plan pending
FORMULA:C19H17N5O3

SMILES: Nc1nc2cccc(-c3cccn4c(C(=O)N5CCOCC5)cnc34)c2o1

BIRTHDAY: 2018-11-19T08:15:00.240678
ATC: C05C
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- CAPILLARY STABILIZING AGENTS
Synthesis plan pending
FORMULA:C18H20N6O3

SMILES: N[C@]12C=CC=C[C@@]1([C@@]13N=C(C(=O)N4CCOCC4)NC1=CC=CN3)N=CO2

BIRTHDAY: 2018-11-19T08:15:00.262749
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis plan pending
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@H]1C=CC=C2[C@]12N=C(C(=O)N3CCOCC3)NC1=CC=CN2

BIRTHDAY: 2018-11-19T08:15:00.273267
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis plan pending
FORMULA:C18H21N5O3S

SMILES: N[C@@]12C=CC=C([C@]34NC=CC=C3N=C([C@H]3CCCCS3(=O)=O)N4)[C@@H]1N=CO2

BIRTHDAY: 2018-11-19T08:15:00.283767
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C19H25N5O2

SMILES: CC(C)(C)N[C@]12C=C(c3ncc(N4CCOCC4)cn3)C=C[C@@H]1N=CO2

BIRTHDAY: 2018-11-19T08:15:00.292737
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis plan pending
FORMULA:C21H26N4O

SMILES: C[C@]1(c2nc3c(c(=O)[nH]2)[C@]24C=CC=N[C@H]2[C@H]3C4)CC[C@H]2CCC[C@@H](C1)N2

BIRTHDAY: 2018-11-19T08:15:00.301514
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis plan pending
FORMULA:C19H26N6O3

SMILES: CC(C)(C)C(=O)N1CCCC[C@H]1N1C(=O)N[C@@]23C=CC=C[C@@]12NN=C3C(N)=O

BIRTHDAY: 2018-11-19T08:15:00.312630
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@H]1C=CC=C2[C@@]12NC=CC=C1N=C(C(=O)N1CCOCC1)N2

BIRTHDAY: 2018-11-19T08:15:00.323102
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 pending
FORMULA:C18H20N6O3

SMILES: N[C@]12C=CC=C[C@@]1([C@@]13NC=CC=C1N=C(C(=O)N1CCOCC1)N3)N=CO2

BIRTHDAY: 2018-11-19T08:15:00.342856
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C26H19N5O5

SMILES: Nc1nc2ccc(-c3ccc4nc5c6cc(C(=O)N7CCOCC7)ccc6oc(=O)c5n4c3)cc2o1

BIRTHDAY: 2018-11-19T08:15:00.354357
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis plan pending
FORMULA:C14H20Cl2N2

SMILES: CC(C)N(Cc1cc(Cl)cc(Cl)c1)[C@H]1CCCN1

BIRTHDAY: 2018-11-19T08:15:00.361266
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C18H33N3O5

SMILES: CC(C)(C)C(=O)N[C@H](CCCCN)C(=O)N1CC[C@@]2(O)O[C@@H](O)C[C@@H]2C1

BIRTHDAY: 2018-11-19T08:15:00.370057
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis plan pending
FORMULA:C18H30N6O2

SMILES: CC(C)(C)C(=O)Nc1n[nH]c2c1N(C(=O)[C@]1(N)CCCCN1)CC2(C)C

BIRTHDAY: 2018-11-19T08:15:00.379693
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C19H35N5O4

SMILES: CC(C)(C)C(=O)N[C@H](CCC(N)=O)C(=O)N1CCC[C@H](C(=O)NCCCN)C1

BIRTHDAY: 2018-11-19T08:15:00.389070
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis plan pending
FORMULA:C30H34N4O4

SMILES: O=C(C(O)O)N1CCC(n2c(=O)n(C3CCN(Cc4ccc5ccccc5c4)CC3)c3ccccc32)CC1

BIRTHDAY: 2018-11-19T08:15:00.400222
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C31H35N5O6S

SMILES: O=C(c1c2c(nn1[C@@H]1CCCCN1C(=O)c1ccccc1N1CCOCC1)C=C1C=CC=C[C@@H]1S2(=O)=O)N1CCOCC1

BIRTHDAY: 2018-11-19T08:15:00.414370
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis plan pending
FORMULA:C25H34N6O3

SMILES: CO[C@@H](C)N(CC(=O)Nc1ccccc1-c1ccnc2c1C[C@@H](N)N=C2)[C@@H](C)N1CCOCC1

BIRTHDAY: 2018-11-19T08:15:00.425331
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
FORMULA:C21H24N6O3S

SMILES: CS(=O)(=O)N[C@@H]1CCCCN1c1cnc2c(n1)C=C[C@H](c1cccc3oc(N)nc13)C2

BIRTHDAY: 2018-11-19T08:15:00.436162
ATC: C01B
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- ANTIARRHYTHMICS, CLASS I AND III
Synthesis plan pending
FORMULA:C18H29N5O3

SMILES: Cn1ncnc1CC[C@H](NC(=O)C(C)(C)C)C(=O)N1C[C@H]2COC[C@H]2C1

BIRTHDAY: 2018-11-19T08:15:00.477546
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C18H30N6O2

SMILES: CC(C)(C)C(=O)Nc1n[nH]c2c1N(C(=O)[C@@]1(N)CCCCN1)CC2(C)C

BIRTHDAY: 2018-11-19T08:15:00.497527
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis plan pending
FORMULA:C15H20N6O2

SMILES: CC(=O)Nc1cnc(N2CCOCC2)nc1-n1ncc(C)c1C

BIRTHDAY: 2018-11-19T08:15:00.506658
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H19N5O3

SMILES: N[C@@]12C=CC=C(c3cccn4c(C(=O)N5CCOCC5)cnc34)[C@@H]1OC=N2

BIRTHDAY: 2018-11-19T08:15:00.516317
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis plan pending
FORMULA:C18H21N5O4S

SMILES: CS(=O)(=O)Nc1ccccc1[C@@]12N=C(C(=O)N3CCOCC3)NC1=CC=CN2

BIRTHDAY: 2018-11-19T08:15:00.526710
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis plan pending
FORMULA:C24H26N6O3

SMILES: CC(C)C(=O)N1CCC(n2c(=O)[nH]c3cc4cnn(-c5ccc(C(N)=O)cc5)c4cc32)CC1

BIRTHDAY: 2018-11-19T08:15:00.537610
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C24H26N6O3

SMILES: CC(C)C(=O)N1CCC(n2c(=O)[nH]c3cc4cnn(-c5cccc(C(N)=O)c5)c4cc32)CC1

BIRTHDAY: 2018-11-19T08:15:00.558419
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C14H19F3N2O

SMILES: CC(C)[C@H](N)C(=O)N1C[C@H]2C=CC=C[C@]2(C(F)(F)F)C1

BIRTHDAY: 2018-11-19T08:15:00.566395
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C24H32Cl2N4O3

SMILES: CC(C)(C)C(=O)N1CCC(N2CNC(=O)C23CCN(C(=O)c2ccc(Cl)c(Cl)c2)CC3)CC1

BIRTHDAY: 2018-11-19T08:15:00.577116
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis plan pending
FORMULA:C18H18N6O3

SMILES: Nc1nc2cc(C3=CC=C4N=CN[C@]4(C(=O)N4CCOCC4)N3)ccc2o1

BIRTHDAY: 2018-11-19T08:15:00.587049
ATC: C01E
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- OTHER CARDIAC PREPARATIONS
Synthesis plan pending
FORMULA:C22H35N5O2

SMILES: CC(C)(C)C(=O)N1CCCC[C@@H]1N1C(=O)N[C@]2(N3CCCC[C@@H]3N)C=CC=C[C@@H]12

BIRTHDAY: 2018-11-19T08:15:00.597637
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis plan pending
FORMULA:C24H35N7O2

SMILES: CC(C)(C)C(=O)N1CCCC[C@@H]1N1C(=O)CN[C@@]12NCCC[C@@]2(N)c1cc2[nH]ccc2cn1

BIRTHDAY: 2018-11-19T08:15:00.619084
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C15H20N6O2

SMILES: CC(=O)Nc1cc(-n2nc(C)cc2C)nc(N2CCOCC2)n1

BIRTHDAY: 2018-11-19T08:15:00.638822
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis plan pending
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@H]1C=CC=C2[C@@]12N=C(C(=O)N3CCOCC3)NC1=CC=CN2

BIRTHDAY: 2018-11-19T08:15:00.649358
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis plan pending
FORMULA:C24H34F3N5O2

SMILES: CC(C)(C)C(=O)N1CCCC[C@H]1N1C(=O)CN[C@]12NCCC[C@@]2(N)c1ccccc1C(F)(F)F

BIRTHDAY: 2018-11-30T17:23:57.414781
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@@H]1C=CC=C2[C@]12NC=CC=C1N=C(C(=O)N1CCOCC1)N2

BIRTHDAY: 2018-11-30T17:23:57.436186
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:C30H33N5O2

SMILES: Cc1cccnc1-c1c(C)ccc2c1C1=CC=CN3C(=O)CN([C@H]4CCCCN4C(=O)C(C)C)[C@@]13N=C2

BIRTHDAY: 2018-11-30T17:23:57.468910
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:C21H23ClN6O2

SMILES: Cc1cnn(-c2ncnc(N3CCO[C@@H](C)C3)c2NC(=O)c2cccc(Cl)c2)c1C

BIRTHDAY: 2018-11-30T17:23:57.491693
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C24H29N7O2

SMILES: Cn1cc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)C(C)(C)C)CC2)c(=O)n4C)cn1

BIRTHDAY: 2018-11-30T17:23:57.502902
ATC: N02A
- NERVOUS SYSTEM
- ANALGESICS
- OPIOIDS
Synthesis Plan
FORMULA:C22H22N6O2

SMILES: CC(=O)NC1CCN(c2cnc3c(-c4ccc5oc(N)nc5c4)cccc3n2)CC1

BIRTHDAY: 2018-11-30T17:23:57.523270
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C22H35N5O2

SMILES: CC(C)(C)C(=O)N1CCCC[C@@H]1N1C(=O)N[C@@]2(N3CCCC[C@@H]3N)C=CC=C[C@@H]12

BIRTHDAY: 2018-11-30T17:23:57.533751
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C19H19N5O3

SMILES: N[C@]12C=CC=C(c3ccc4nc(C(=O)N5CCOCC5)cn4c3)[C@@H]1OC=N2

BIRTHDAY: 2018-12-02T16:07:05.436250
ATC: L02B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ENDOCRINE THERAPY
- HORMONE ANTAGONISTS AND RELATED AGENTS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12C=CC=C[C@]1(C1=CC=C3NC(C(=O)N4CCOCC4)=N[C@@H]3N1)N=CO2

BIRTHDAY: 2018-12-02T16:07:05.499069
ATC: L01B
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ANTIMETABOLITES
Synthesis Plan
FORMULA:C25H38FN3O4

SMILES: CC(C)(C)C(=O)N[C@H](CCCCN)C(=O)N1CC[C@@H]2O[C@H](OCc3ccc(F)cc3)C[C@H]2C1

BIRTHDAY: 2018-12-02T16:07:05.517802
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H31N7O3

SMILES: COCC(=O)N1CCCC[C@@H]1N1CC(=O)N2C=Cc3nccc(-c4ccnn4C(C)C)c3[C@]21N

BIRTHDAY: 2018-12-02T16:07:05.530555
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C22H30N6O3

SMILES: c1ccc(N2CCOCC2)c(Nc2cnc(N3CCOCC3)nc2N2CCOCC2)c1

BIRTHDAY: 2018-12-02T16:07:05.540750
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C23H22F3N3O

SMILES: CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(-c2cccnc2)cc1

BIRTHDAY: 2018-12-02T16:07:05.550139
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C19H25N5O2

SMILES: CC(C)(C)N[C@@]12C=CC=C[C@@]1(c1ncc(N3CCOCC3)cn1)N=CO2

BIRTHDAY: 2018-12-02T16:07:05.559053
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12N=CO[C@H]1C=CC=C2[C@@]12N=C(C(=O)N3CCOCC3)NC1=CC=CN2

BIRTHDAY: 2018-12-03T10:43:27.387355
ATC: S01X
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OTHER OPHTHALMOLOGICALS
Synthesis Plan
FORMULA:C24H31N7O3

SMILES: COCC(=O)N1CCCC[C@H]1N1CC(=O)N2C=Cc3nccc(-c4ccnn4C(C)C)c3[C@]21N

BIRTHDAY: 2018-12-03T10:43:27.400174
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@]12C=CC=C[C@]1([C@@]13N=C(C(=O)N4CCOCC4)NC1=CC=CN3)N=CO2

BIRTHDAY: 2018-12-03T10:43:27.421671
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis Plan
FORMULA:C22H30F3N5O2

SMILES: CC(C)C(=O)N1CCCC[C@H]1N1C(=O)N[C@@]23C(C(F)(F)F)=CC=C[C@]12C=NN3C(C)(C)C

BIRTHDAY: 2018-12-03T10:43:27.455241
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H27F3N2O

SMILES: CC(C)(C)[C@H]1CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)nc2)CCO1

BIRTHDAY: 2018-12-03T10:43:27.474632
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C25H33N7O3

SMILES: COCC(=O)N1CCCC[C@H]1N1CC(=O)N2c3cc(-c4ccnn4C(C)(C)C)cnc3C=C[C@@]21N

BIRTHDAY: 2018-12-03T10:43:27.486011
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C21H20N4O

SMILES: C[C@@H]1C[C@H]2CC[C@@H]1c1nc3ccc(-c4ccc5oc(N)nc5c4)cn3c12

BIRTHDAY: 2018-12-03T10:43:27.504152
ATC: G03G
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- GONADOTROPINS AND OTHER OVULATION STIMULANTS
Synthesis Plan
FORMULA:C24H27N7O2

SMILES: CC(C)C(=O)N1CCC(n2c(=O)[nH]c3ccc4cnn(-c5cccc(C(=N)N)c5)c4c32)CC1

BIRTHDAY: 2018-12-03T10:43:27.516538
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C28H20F3N3O2

SMILES: O=C(Nc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1)c1ccc(/C=N/c2ccccc2)cc1

BIRTHDAY: 2018-12-03T19:11:52.163200
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@@H]1C=CC=C2[C@@]12NC=CC=C1N=C(C(=O)N1CCOCC1)N2

BIRTHDAY: 2018-12-03T19:11:52.173658
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:C18H20N6O3

SMILES: N[C@@]12C=CC=C([C@H]3NC=Cc4[nH]c(C(=O)N5CCOCC5)nc43)[C@H]1N=CO2

BIRTHDAY: 2018-12-03T19:11:52.183569
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C19H19N5O3

SMILES: Nc1nc2c(C3=CN4C=CN[C@@]4(C(=O)N4CCOCC4)C=C3)cccc2o1

BIRTHDAY: 2018-12-03T19:11:52.225306
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C16H15N5O2S

SMILES: N[C@@]12C=CC=C(C3=CC=CN4C=CN[C@]34C3=CNSO3)[C@H]1N=CO2

BIRTHDAY: 2018-12-03T19:11:52.245985
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis Plan
FORMULA:C24H29N7O2

SMILES: CC(C)C(=O)N1CCCC[C@H]1N1C(=O)N[C@]23C=CC=C[C@@]12C=NN3c1ccccc1C(=N)N

BIRTHDAY: 2018-12-03T19:11:52.258203
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C20H21Cl2N5O

SMILES: COCCN(Cc1cccc(Cl)c1Cl)c1ccnc(NCc2cccnc2)n1

BIRTHDAY: 2018-12-03T19:11:52.267780
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C17H25N7O3

SMILES: c1nc2nc(N3CCOCC3)nc(N3CCOCC3)c2n1[C@@H]1COCCN1

BIRTHDAY: 2018-12-03T19:11:52.288661
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12C=CC=C([C@]34N=C(C(=O)N5CCOCC5)NC3=CC=CN4)[C@H]1OC=N2

BIRTHDAY: 2018-12-01T22:30:58.200313
ATC: S01L
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OCULAR VASCULAR DISORDER AGENTS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12C=CC=C[C@]1([C@@H]1C=c3nc(C(=O)N4CCOCC4)[nH]c3=CN1)N=CO2

BIRTHDAY: 2018-12-01T22:30:58.210202
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C22H19F3N6O5

SMILES: O=C(C(O)O)N1CCC(Nc2nc3c(-c4noc(-c5cccc(C(F)(F)F)n5)n4)cccc3o2)CC1

BIRTHDAY: 2018-12-01T22:30:58.222539
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C33H39Cl3N2O2

SMILES: N[C@@]1(c2ccccc2Cl)CCOC(=O)CCCCC[C@@H](c2cc(Cl)cc(Cl)c2)CCCCCNc2ccc1cc2

BIRTHDAY: 2018-12-01T22:30:58.285280
ATC: H05B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CALCIUM HOMEOSTASIS
- ANTI-PARATHYROID AGENTS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12OC=N[C@@H]1C=CC=C2[C@]12N=C(C(=O)N3CCOCC3)NC1=CC=CN2

BIRTHDAY: 2018-12-01T22:30:58.305635
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C18H20N6O3

SMILES: N[C@@]12C=CC=C[C@@]1([C@]13N=C(C(=O)N4CCOCC4)NC1=CC=CN3)N=CO2

BIRTHDAY: 2018-12-01T22:30:58.316293
ATC: H01C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- HYPOTHALAMIC HORMONES
Synthesis Plan