matter.farm

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

These compounds may interact with:

P2X purinoceptor 3

Potentially involved in: carcinoma; interstitial cystitis; migraine; neurogenic bladder; pain disorder; irritable bowel syndrome; pain agnosia; low compliance bladder; hyperalgesia; trauma, nervous system

Disease data sourced from Pharos.

Antagonist

FORMULA:C25H23N3O5

SMILES: COc1cccc([C@@]23C(=O)N(c4ccccc4-c4ccoc4)C[C@@H]2NN=C3[C@@H](C)C(=O)O)c1

BIRTHDAY: 2018-12-01T14:10:56.186317
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C30H25N3O4

SMILES: COc1ccccc1[C@H]1c2c(n[nH]c2CCc2ccc(O)cc2)C(=O)N1c1ccc(-c2ccco2)cc1

BIRTHDAY: 2018-12-01T14:10:56.197043
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@@H]1C(=O)N(c2ccccc2-c2ccco2)C(=O)[C@@H]1c1ccc(O[C@H](C)O)cc1

BIRTHDAY: 2018-12-01T14:10:56.208141
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C25H21N3O5

SMILES: COc1ccccc1[C@@H]1c2c(n[nH]c2CCC(=O)O)C(=O)N1c1ccc(-c2ccco2)cc1

BIRTHDAY: 2018-12-01T14:10:56.218324
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@@H]1c1ccccc1OCC1CC1

BIRTHDAY: 2018-12-01T14:10:56.228956
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C25H21N3O5

SMILES: COc1ccccc1[C@H]1c2c(n[nH]c2CCC(=O)O)C(=O)N1c1ccc(-c2ccco2)cc1

BIRTHDAY: 2018-12-01T14:10:56.239151
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@@]1(c2ccc(OCC(F)(F)F)cc2)C(=O)C(=O)CN1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-01T14:10:56.251752
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@]1(c2ccc(OC3(C)CC3)cc2)C(=O)CC(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-01T14:10:56.295531
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@@]23C=NN[C@@]2(C(C)(C)CO)CN(c2ccccc2-c2ccco2)C3=O)c1

BIRTHDAY: 2018-12-01T14:10:56.306213
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@@H]1c1ccccc1OCC(F)(F)F

BIRTHDAY: 2018-12-01T14:10:56.317746
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@]1(c2cccc(OC3(C)CC3)c2)C(=O)C(=O)CN1c1ccccc1-c1ccoc1

BIRTHDAY: 2018-12-01T14:10:56.329111
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@H]1c1ccccc1OCC1CC1

BIRTHDAY: 2018-12-01T14:10:56.339762
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C30H29F3N4O

SMILES: CC(C)c1ccc2cc1CCCOc1cc(ccc1-c1ccccc1C(F)(F)F)CNc1ccnc(n1)N2

BIRTHDAY: 2018-12-01T14:10:56.350853
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)[C@@H](c2ccc(OCC(F)(F)F)cc2)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-01T14:10:56.362496
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@]1(c2ccc(OC3(C)CC3)cc2)C(=O)C(=O)CN1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-01T14:10:56.374362
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C26H25N3O4

SMILES: COc1ccccc1[C@@H]1c2c(n[nH]c2C(C)(C)CO)C(=O)N1c1ccc(-c2ccoc2)cc1

BIRTHDAY: 2018-12-01T14:10:56.385830
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1cccc([C@]23C=NN[C@]2([C@@H](C)C(=O)O)CN(c2ccccc2-c2ccoc2)C3=O)c1

BIRTHDAY: 2018-12-25T02:02:59.326201
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C24H26N2O5

SMILES: CC(C)C(=O)[C@@]1(N2CC=CO[C@@]3(OCc4ccccc4)C=CC=C[C@@H]23)NCC(=O)C1=O

BIRTHDAY: 2018-12-25T02:02:59.337245
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C26H25N3O4

SMILES: COc1ccccc1[C@H]1c2c(n[nH]c2C(C)(C)CO)C(=O)N1c1ccc(-c2ccoc2)cc1

BIRTHDAY: 2018-12-25T02:02:59.348888
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)N(c2ccc(-c3ccco3)cc2)[C@@H]1c1ccccc1OCC1CC1

BIRTHDAY: 2018-12-25T02:02:59.359612
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@H]1[C@@H](c2ccc(OC3(C)CC3)cc2)C(=O)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-25T02:02:59.370849
ATC: G04B
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- UROLOGICALS
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)N(c2ccc(-c3ccco3)cc2)[C@@H]1c1ccccc1OCC(F)(F)F

BIRTHDAY: 2018-12-25T02:02:59.382533
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C25H23NO5

SMILES: COc1ccccc1[C@@H]1[C@H](C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccco2)cc1

BIRTHDAY: 2018-12-25T02:02:59.393329
ATC: M05B
- MUSCULO-SKELETAL SYSTEM
- DRUGS FOR TREATMENT OF BONE DISEASES
- DRUGS AFFECTING BONE STRUCTURE AND MINERALIZATION
Synthesis Plan
FORMULA:C24H39N3O3

SMILES: COc1ccccc1[C@H]1CC(=O)N([C@H]2CCCCNCCN[C@@H](CO)CCCC2)C1

BIRTHDAY: 2018-12-25T02:02:59.413995
ATC: C04A
- CARDIOVASCULAR SYSTEM
- PERIPHERAL VASODILATORS
- PERIPHERAL VASODILATORS
Synthesis Plan
FORMULA:C20H21N2O3PS

SMILES: COc1ccccc1[C@@H]1CC(=O)N(C2=N[C@H](c3cccs3)C3(CC3)PO2)C1

BIRTHDAY: 2018-12-25T02:02:59.434244
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)[C@H](c2ccc(OC3(C)CC3)cc2)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-25T02:02:59.445139
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C6H11N3

SMILES: CC(C)[C@@H]1N=CC(N)=N1

BIRTHDAY: 2018-12-25T02:02:59.450630
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2ccccc2-c2ccoc2)[C@@H]1c1ccccc1OCCO

BIRTHDAY: 2018-12-25T02:02:59.461589
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@@]23CC(=O)N(c4ccccc4-c4ccco4)[C@H]2NN=C3C(C)(C)CO)c1

BIRTHDAY: 2018-12-25T02:02:59.472636
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C19H21F2NO4

SMILES: CC1(C)CCO[C@@](C)(C2=C(c3cc(F)cc(F)c3)C(=O)NC2=O)COC1

BIRTHDAY: 2018-12-25T02:02:59.481538
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1cccc([C@]23NN=C[C@@]2([C@H](C)C(=O)O)N(c2ccccc2-c2ccoc2)CC3=O)c1

BIRTHDAY: 2018-12-25T02:02:59.492357
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@@H]1c1ccccc1OCC1CC1

BIRTHDAY: 2018-12-25T02:02:59.503135
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@H]1c1ccccc1OCC(F)(F)F

BIRTHDAY: 2018-12-03T02:39:03.051011
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@@]1(c2ccc(O[C@@H](C)O)cc2)C(=O)CC(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-03T02:39:03.075227
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@]1(c2ccc(OC3(C)CC3)cc2)C(=O)CC(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-03T02:39:03.087371
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@@H]1c1ccccc1OCC(F)(F)F

BIRTHDAY: 2018-12-03T02:39:03.120751
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@]1(c2ccc(O[C@H](C)O)cc2)CC(=O)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-03T02:39:03.132315
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@@H]2C(=O)N(c3ccccc3-c3ccco3)[C@@H]3NN=C[C@@]23C(C)(C)CO)c1

BIRTHDAY: 2018-12-03T02:39:03.154095
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C18H24N2OS

SMILES: CC(C)(C)c1ncc(C(=O)Nc2ccccc2C(C)(C)C)s1

BIRTHDAY: 2018-12-03T02:39:03.161335
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@]23CN(c4ccccc4-c4ccco4)C(=O)[C@@]2(C(C)(C)CO)C=NN3)c1

BIRTHDAY: 2018-12-03T02:39:03.196516
ATC: C05A
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- AGENTS FOR TREATMENT OF HEMORRHOIDS AND ANAL FISSURES FOR TOPICAL USE
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@@H]1[C@H](c2ccc(OCC(F)(F)F)cc2)C(=O)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-03T02:39:03.208426
ATC: C04A
- CARDIOVASCULAR SYSTEM
- PERIPHERAL VASODILATORS
- PERIPHERAL VASODILATORS
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1cccc([C@@]23CC(=O)N(c4ccccc4-c4ccoc4)[C@@]2([C@H](C)C(=O)O)C=NN3)c1

BIRTHDAY: 2018-12-03T02:39:03.219973
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2ccc(-c3ccco3)cc2)[C@@H]1c1ccccc1OCC1CC1

BIRTHDAY: 2018-12-03T02:39:03.230669
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1ccccc1[C@H]1C(=O)N(c2ccccc2-c2ccoc2)[C@]2([C@@H](C)C(=O)O)C=NN[C@@H]12

BIRTHDAY: 2018-12-03T02:39:03.242960
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C18H16OS

SMILES: CC(C)C(=O)C1=Cc2ccccc2Sc2ccccc21

BIRTHDAY: 2018-11-30T03:41:00.163728
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C27H27NO6

SMILES: COCCOc1cccc([C@@H]2[C@H](C(=O)C(C)C)C(=O)C(=O)N2c2ccc(-c3ccco3)cc2)c1

BIRTHDAY: 2018-11-30T03:41:00.185824
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C15H20N2O2

SMILES: C[C@H]1COc2cnc(C#N)c(c2)CCCCO[C@H]1C

BIRTHDAY: 2018-11-30T03:41:00.192987
ATC: G04B
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- UROLOGICALS
Synthesis Plan
FORMULA:C26H25N3O4

SMILES: COc1ccc([C@H]2c3c(n[nH]c3C(C)(C)CO)C(=O)N2c2ccc(-c3ccoc3)cc2)cc1

BIRTHDAY: 2018-11-30T03:41:00.203115
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C26H25N3O4

SMILES: COc1cccc([C@H]2C(=O)N(c3ccccc3-c3ccco3)c3c2n[nH]c3C(C)(C)CO)c1

BIRTHDAY: 2018-11-30T03:41:00.224697
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)[C@@H](c2ccc(OC3(C)CC3)cc2)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-11-30T03:41:00.235444
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C25H21N5O5

SMILES: COc1ccc([C@H]2c3c(nn4c3N=N[C@@H](CO)[C@@H]4O)C(=O)N2c2ccc(-c3ccco3)cc2)cc1

BIRTHDAY: 2018-11-30T03:41:00.258700
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@@]23C=NN[C@]2(C(C)(C)CO)N(c2ccccc2-c2ccco2)C(=O)C3)c1

BIRTHDAY: 2018-11-30T03:41:00.269300
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C25H23NO5

SMILES: COc1ccc([C@@H]2C(=O)C(=O)N(c3ccccc3-c3ccoc3)[C@H]2C(=O)C(C)C)cc1

BIRTHDAY: 2018-11-30T03:41:00.279881
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C16H20N2O4S

SMILES: CC(C)Oc1cccc(C(=O)C2=CC(C(C)C)=NS(=O)(=O)N2)c1

BIRTHDAY: 2018-11-30T03:41:00.299914
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C24H27N3O4

SMILES: COc1cccc([C@H]2NC(=O)[C@@]34CNC[C@H](CN(Cc5ccc6c(c5)OCO6)C3)[C@@H]24)c1

BIRTHDAY: 2018-11-30T03:41:00.321842
ATC: M03B
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS
Synthesis Plan
FORMULA:C26H26N2O6

SMILES: COCCOc1ncccc1[C@@H]1[C@@H](C(=O)C(C)C)C(=O)C(=O)N1c1ccc(-c2ccoc2)cc1

BIRTHDAY: 2018-11-30T03:41:00.343864
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@@]1(c2ccc(OCC(F)(F)F)cc2)CC(=O)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-11-19T08:12:10.417616
ATC: J04A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOBACTERIALS
- DRUGS FOR TREATMENT OF TUBERCULOSIS
Synthesis Plan
FORMULA:C31H32N2O5

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)N(c2ccc(-c3ccco3)cc2)[C@@H]1c1cccc(OC[C@H]2CN3CC[C@H]2C3)c1

BIRTHDAY: 2018-11-19T08:12:10.428726
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2cccc(-c3ccoc3)c2)[C@H]1c1ccc(OCCO)cc1

BIRTHDAY: 2018-11-19T08:12:10.439508
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C19H31N3O5S

SMILES: CC1(C)Nc2ncc3c(c2NSC1(C)C)OCCOCCOCCOCCO3

BIRTHDAY: 2018-11-19T08:12:10.472319
ATC: B03B
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- VITAMIN B12 AND FOLIC ACID
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@@]1(c2ccc(O[C@H](C)O)cc2)CC(=O)N(c2ccccc2-c2ccco2)C1=O

BIRTHDAY: 2018-11-19T08:12:10.495012
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis Plan
FORMULA:C26H25N3O4

SMILES: COc1cccc([C@@H]2C(=O)N(c3ccccc3-c3ccoc3)c3n[nH]c(C(C)(C)CO)c32)c1

BIRTHDAY: 2018-11-19T08:12:10.505550
ATC: R07A
- RESPIRATORY SYSTEM
- OTHER RESPIRATORY SYSTEM PRODUCTS
- OTHER RESPIRATORY SYSTEM PRODUCTS
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@@H]1c1ccccc1OCCO

BIRTHDAY: 2018-11-19T08:12:10.516245
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1ccc([C@@]23NN=C(C(C)(C)CO)[C@@H]2N(c2ccccc2-c2ccco2)CC3=O)cc1

BIRTHDAY: 2018-11-19T08:12:10.527247
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C26H32N4O3

SMILES: COc1ccc([C@H]2CNC[C@@H]2C(=O)C2=NNCC(OCCCCCc3ccccc3)=N2)cc1

BIRTHDAY: 2018-11-19T08:12:10.537277
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C25H24N2O7

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@@H]1c1cccnc1OCC(O)O

BIRTHDAY: 2018-11-19T08:12:10.549205
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)[C@@H](c2ccc(OC3(C)CC3)cc2)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-11-19T08:12:10.560163
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C26H25N3O4

SMILES: COc1cccc([C@H]2C(=O)N(c3ccccc3-c3ccco3)c3n[nH]c(C(C)(C)CO)c32)c1

BIRTHDAY: 2018-11-19T08:12:10.570692
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C17H15NO2S5

SMILES: COc1ccccc1[C@@H]1C(=O)CCN1c1ccc2c(c1)SSSSS2

BIRTHDAY: 2018-11-19T08:12:10.580102
ATC: C08C
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH MAINLY VASCULAR EFFECTS
Synthesis Plan
FORMULA:C24H28O7

SMILES: COc1ccc(C2=C(O)CCOC(=O)CCC=CCCC[C@@]23C=COCC(=O)O3)cc1

BIRTHDAY: 2018-11-19T08:12:10.590246
ATC: C01E
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- OTHER CARDIAC PREPARATIONS
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1ccccc1[C@@]12NN=C(C(C)(C)CO)[C@@H]1CN(c1ccc(-c3ccoc3)cc1)C2=O

BIRTHDAY: 2018-11-19T08:12:10.600592
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@]1(c2cccc(OC3(C)CC3)c2)CC(=O)C(=O)N1c1ccccc1-c1ccoc1

BIRTHDAY: 2018-11-19T08:12:10.611720
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C28H31N7O3S2

SMILES: Cc1cn2c(n1)CCNCc1nc(cs1)C1=N[C@H](CNc3ccc(N4C(=O)C[C@@H](C(=O)C(C)C)C4=O)cc3-2)CS1

BIRTHDAY: 2018-11-19T08:12:10.635469
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@@]23CC(=O)N(c4ccccc4-c4ccco4)[C@@H]2C(C(C)(C)CO)=NN3)c1

BIRTHDAY: 2018-11-19T08:12:10.646926
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@@]23NN=C(C(C)(C)CO)[C@@H]2N(c2ccccc2-c2ccco2)CC3=O)c1

BIRTHDAY: 2018-11-19T08:12:10.669568
ATC: A05A
- ALIMENTARY TRACT AND METABOLISM
- BILE AND LIVER THERAPY
- BILE THERAPY
Synthesis Plan
FORMULA:C30H27N3O4

SMILES: COc1cccc([C@H]2C(=O)N(c3ccccc3-c3ccco3)[C@H]3NN=C[C@]32[C@@H](C)c2ccccc2O)c1

BIRTHDAY: 2018-11-19T08:12:10.680990
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C25H21N3O5

SMILES: COc1ccc([C@@H]2c3c(n[nH]c3CCC(=O)O)C(=O)N2c2ccc(-c3ccco3)cc2)cc1

BIRTHDAY: 2018-11-19T08:12:10.692908
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C29H31N5O7

SMILES: Cc1ncc2nc1OCCC[C@@]1(C(=O)C(C)C)C(=O)C(=O)N(c3ccccc3-c3ccoc3)[C@@H]1OC(=O)CNCN2

BIRTHDAY: 2018-11-19T08:12:10.710218
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@]1(c2cccc(OC3(C)CC3)c2)CC(=O)C(=O)N1c1ccccc1-c1ccoc1

BIRTHDAY: 2018-11-19T08:12:10.732447
ATC: A16A
- ALIMENTARY TRACT AND METABOLISM
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
- OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
Synthesis Plan
FORMULA:C18H15FO2S2

SMILES: C[C@H]1SC=C(c2cccc(OCC(=O)c3cccc(F)c3)c2)S1

BIRTHDAY: 2018-11-19T08:12:10.741092
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@@H]1c1ccccc1OCCO

BIRTHDAY: 2018-11-19T08:12:10.756167
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@H]2C(=O)N(c3ccccc3-c3ccco3)[C@@H]3NN=C[C@@]23C(C)(C)CO)c1

BIRTHDAY: 2018-11-19T08:12:10.771725
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C23H21N3O4

SMILES: Cc1cc2cc(c1)C(=O)NCCNCC(=O)NC(=O)c1cccc3ccc(cc13)O2

BIRTHDAY: 2018-11-19T08:12:10.785342
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@]23C=NN[C@]2(C(C)(C)CO)N(c2ccccc2-c2ccco2)C(=O)C3)c1

BIRTHDAY: 2018-11-19T08:12:10.816205
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C19H21NO3

SMILES: CC(C)[C@@H]1C[C@@H](c2ccccc2O)OC(c2ccccc2O)=N1

BIRTHDAY: 2018-11-19T08:12:10.844143
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@H]1[C@H](c2ccc(OC3(C)CC3)cc2)C(=O)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-11-19T08:12:10.923405
ATC: G04B
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- UROLOGICALS
Synthesis Plan
FORMULA:C23H27N3O4S

SMILES: CC(C)C(=O)[C@]1(c2ccccc2[C@@]2(O)CON=CN2)CCN(C(=O)Cc2ccsc2)C1

BIRTHDAY: 2018-11-19T08:12:10.939385
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C12H9F2N3OS2

SMILES: COC1=Nc2nc(Nc3c(F)cccc3F)sc2SC1

BIRTHDAY: 2018-11-19T08:12:10.950957
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@H]1[C@@H](c2ccc(OCC(F)(F)F)cc2)C(=O)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-11-19T08:12:10.967772
ATC: C04A
- CARDIOVASCULAR SYSTEM
- PERIPHERAL VASODILATORS
- PERIPHERAL VASODILATORS
Synthesis Plan
FORMULA:C30H25N3O4

SMILES: COc1ccccc1[C@H]1c2c(n[nH]c2CCc2cccc(O)c2)C(=O)N1c1ccc(-c2ccco2)cc1

BIRTHDAY: 2018-11-19T08:12:10.982944
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@]1(c2ccc(OC3(C)CC3)cc2)CC(=O)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-11-19T08:12:10.999278
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@H]1C(=O)[C@H](c2ccc(OC3(C)CC3)cc2)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-11-19T08:12:11.014494
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C26H25N3O4

SMILES: COc1cccc([C@@H]2C(=O)N(c3ccccc3-c3ccco3)c3c2n[nH]c3C(C)(C)CO)c1

BIRTHDAY: 2018-11-19T08:12:11.029900
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C26H27N3O5

SMILES: COc1cccc([C@@H]2C(=O)N(c3ccccc3-c3ccco3)[C@@H]3NN=C[C@@]23C(C)(CO)CO)c1

BIRTHDAY: 2018-11-19T08:12:11.045650
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@@H]2C(=O)N(c3ccccc3-c3ccco3)[C@@H]3C(C(C)(C)CO)=NN[C@@H]23)c1

BIRTHDAY: 2018-11-19T08:12:11.061962
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C29H27N3O5

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@@H]1c1ccccc1OCC1=NCNC=C1

BIRTHDAY: 2018-11-19T08:12:11.078672
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C26H25N3O4

SMILES: COc1ccccc1[C@@H]1c2c(n[nH]c2C(C)(C)CO)C(=O)N1c1ccc(-c2ccco2)cc1

BIRTHDAY: 2018-11-19T08:12:11.094898
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@H]1c1ccccc1OCCO

BIRTHDAY: 2018-11-19T08:12:11.125136
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1ccccc1[C@]12CN(c3ccccc3-c3ccoc3)C(=O)[C@]1([C@@H](C)C(=O)O)C=NN2

BIRTHDAY: 2018-11-19T08:12:11.140754
ATC: V09D
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- HEPATIC AND RETICULO ENDOTHELIAL SYSTEM
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@@]1(c2ccc(OCC(F)(F)F)cc2)C(=O)CC(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-11-19T08:12:11.173785
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@@H]1C(=O)[C@@H](c2ccc(O[C@@H](C)O)cc2)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-11-19T08:12:11.205733
ATC: D08A
- DERMATOLOGICALS
- ANTISEPTICS AND DISINFECTANTS
- ANTISEPTICS AND DISINFECTANTS
Synthesis Plan
FORMULA:C25H24N2O7

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@@H]1c1cccnc1OCC(O)O

BIRTHDAY: 2018-11-19T08:12:11.221772
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@]1(c2cccc(OC3(C)CC3)c2)CC(=O)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-11-19T08:12:11.237335
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C26H25N3O4

SMILES: COc1ccccc1[C@H]1c2c(n[nH]c2C(C)(C)CO)C(=O)N1c1ccc(-c2ccco2)cc1

BIRTHDAY: 2018-11-19T08:12:11.264075
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C18H24F3NOS3

SMILES: CC1=C(C(=O)C(C)C)SS[S@@]12CCNC[C@]1(C(F)(F)F)C=CC=C[C@@H]1C2

BIRTHDAY: 2018-11-19T08:12:11.273822
ATC: A11D
- ALIMENTARY TRACT AND METABOLISM
- VITAMINS
- VITAMIN B1, PLAIN AND IN COMBINATION WITH VITAMIN B6 AND B12
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1cccc([C@H]2C(=O)N(c3ccccc3-c3ccoc3)[C@]3([C@H](C)C(=O)O)C=NN[C@H]23)c1

BIRTHDAY: 2018-11-30T17:23:22.071534
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C18H15N3O2S

SMILES: c1coc(-c2csc(-c3cccnc3OC34CN5C[C@@H]3[C@@H]4C5)n2)c1

BIRTHDAY: 2018-11-30T17:23:22.102719
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2cccc(-c3ccco3)c2)[C@@H]1c1cccc(OCC2CC2)c1

BIRTHDAY: 2018-11-30T17:23:22.135759
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis Plan
FORMULA:C30H23NO8

SMILES: CC(C)C(=O)[C@H]1C(=O)N(c2ccc(-c3ccco3)cc2)C(=O)[C@@H]1c1ccccc1OC1=C(O)C(=O)C=CC1=O

BIRTHDAY: 2018-11-30T17:23:22.147710
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1ccc([C@]23C=NN[C@@]2([C@@H](C)C(=O)O)N(c2ccccc2-c2ccco2)CC3=O)cc1

BIRTHDAY: 2018-11-30T17:23:22.158215
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C30H34FN5O5S

SMILES: CC(C)C(=O)[C@]1(N2CCCOC(=O)CNC[C@H]3CSC(=N3)c3ccnc(c3)[C@]2(C)c2ccccc2F)NCC(=O)C1=O

BIRTHDAY: 2018-11-30T17:23:22.173788
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1ccc([C@]23CC(=O)N(c4ccccc4-c4ccco4)[C@H]2C(C(C)(C)CO)=NN3)cc1

BIRTHDAY: 2018-11-30T17:23:22.229400
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@]1(c2ccc(OCC(F)(F)F)cc2)C(=O)C(=O)CN1c1ccccc1-c1ccoc1

BIRTHDAY: 2018-12-02T16:06:30.221982
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C23H26N4O5

SMILES: Cc1noc(-c2ccccc2N2[C@H](C(=O)C(C)C)C(=O)C(=O)[C@@H]2N2[C@@H]3CC[C@@H]2COC3)n1

BIRTHDAY: 2018-12-02T16:06:30.245927
ATC: A08A
- ALIMENTARY TRACT AND METABOLISM
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
- ANTIOBESITY PREPARATIONS, EXCL. DIET PRODUCTS
Synthesis Plan
FORMULA:C19H25NO7

SMILES: COc1ccc([C@@H]2C(=O)N[C@H]3[C@@H]2O[C@H]2[C@H](OC)[C@@H](O)[C@]3(OC)[C@@H]2OC)cc1

BIRTHDAY: 2018-12-02T16:06:30.289754
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C17H23NO4

SMILES: CC1=C(C2CCCC2)CO[C@@H]2C(=O)[C@@H](C(=O)C(C)C)C(=O)N12

BIRTHDAY: 2018-12-02T16:06:30.343899
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@]1(c2ccc(OC3(C)CC3)cc2)C(=O)C(=O)CN1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-02T16:06:30.355832
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C38H42N6O5

SMILES: COc1cccc([C@@]23CC(=O)N(c4ccccc4-c4ccco4)[C@H]2C([C@H](C)[C@H]2CCCNc4cccc(c4)NCCN2C(=O)CO)=NN3)c1

BIRTHDAY: 2018-12-03T10:42:51.978814
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)N(c2ccc(-c3ccoc3)cc2)[C@H]1c1ccccc1OCC1CC1

BIRTHDAY: 2018-12-03T10:42:51.989593
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@@H]1C(=O)C(=O)[C@H](c2ccc(OCC(F)(F)F)cc2)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-03T10:42:52.001346
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C42H36N4O6

SMILES: COc1ccccc1[C@H]1C(=O)N(c2ccccc2-c2ccoc2)c2cc3cc(c21)Oc1ccc2cccc(c2c1)CNCCNC(=O)C(=O)CNC3

BIRTHDAY: 2018-12-03T10:42:52.019502
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C26H30N2O6

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)[C@]2(OCCC(C)(C)NCCC2=O)N1c1ccccc1-c1ccoc1

BIRTHDAY: 2018-12-03T10:42:52.052697
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@@]23C(=O)CN(c4ccccc4-c4ccco4)[C@H]2NN=C3C(C)(C)CO)c1

BIRTHDAY: 2018-12-03T10:42:52.063630
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C17H19N3O6

SMILES: CC(C)C(=O)[C@@]1(C(=O)OCc2ccccc2)N[C@@]2([CH+][N-]O[N@@H+]2[O-])CC1=O

BIRTHDAY: 2018-12-03T10:42:52.074855
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C25H21N3O5

SMILES: COc1ccc([C@H]2c3c(n[nH]c3CCC(=O)O)C(=O)N2c2ccc(-c3ccco3)cc2)cc1

BIRTHDAY: 2018-12-03T10:42:52.085314
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C20H14F3N3O3S

SMILES: CSc1nccc([C@@H]2CC(=O)N(C(=O)c3c(F)cc(F)cc3F)[C@H]2c2ccco2)n1

BIRTHDAY: 2018-12-03T10:42:52.130867
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@]1(c2ccc(O[C@H](C)O)cc2)C(=O)C(=O)CN1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-03T10:42:52.142953
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@]23C(=O)N(c4ccccc4-c4ccco4)C[C@@H]2NN=C3C(C)(C)CO)c1

BIRTHDAY: 2018-12-03T10:42:52.154434
ATC: A10A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- INSULINS AND ANALOGUES
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@H]1[C@H](c2ccccc2OCC2CC2)C(=O)C(=O)N1c1cccc(-c2ccoc2)c1

BIRTHDAY: 2018-12-03T10:42:52.177067
ATC: C07A
- CARDIOVASCULAR SYSTEM
- BETA BLOCKING AGENTS
- BETA BLOCKING AGENTS
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1cccc([C@@H]2C(=O)N(c3ccccc3-c3ccoc3)[C@@]3([C@H](C)C(=O)O)C=NN[C@H]23)c1

BIRTHDAY: 2018-12-03T10:42:52.189156
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C19H23N3O4

SMILES: CC(C)C(=O)[C@]12N=N[C@@H](c3ccc(OC(C)(C)C)cc3)[C@H]1C(=O)NC2=O

BIRTHDAY: 2018-12-03T19:11:17.001879
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H22F3NO5

SMILES: CC(C)C(=O)[C@]1(c2ccc(OCC(F)(F)F)cc2)C(=O)C(=O)CN1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-03T19:11:17.048422
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1cccc([C@@]23C=NN[C@]2([C@@H](C)C(=O)O)N(c2ccccc2-c2ccoc2)C(=O)C3)c1

BIRTHDAY: 2018-12-03T19:11:17.059101
ATC: C02A
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, CENTRALLY ACTING
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@@H]1C(=O)[C@@H](c2cccc(OC3(C)CC3)c2)N(c2ccc(-c3ccoc3)cc2)C1=O

BIRTHDAY: 2018-12-03T19:11:17.101244
ATC: J01D
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER BETA-LACTAM ANTIBACTERIALS
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1cccc([C@]23CC(=O)N(c4ccccc4-c4ccoc4)[C@@H]2NN=C3[C@H](C)C(=O)O)c1

BIRTHDAY: 2018-12-03T19:11:17.168956
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C33H52N2OS

SMILES: CSc1cnc(C(=O)[C@H]2CC[C@@]3(CCC[C@@H](C)[C@@]34CCC[C@]3(CC(C)(C)CCC3(C)C)C4(C)C)C2)nc1

BIRTHDAY: 2018-12-01T22:30:21.908138
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@@]23C=NN[C@@]2(C(C)(C)CO)N(c2ccccc2-c2ccoc2)CC3=O)c1

BIRTHDAY: 2018-12-01T22:30:21.929233
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C26H23N3O4

SMILES: COc1ccccc1[C@H]1CC(=O)N(c2ccc(-c3ccco3)cc2)[C@]12C=CN=C(CO)C=N2

BIRTHDAY: 2018-12-01T22:30:21.939439
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C30H25N3O4

SMILES: COc1ccccc1[C@@H]1c2c(n[nH]c2CCc2ccc(O)cc2)C(=O)N1c1ccc(-c2ccco2)cc1

BIRTHDAY: 2018-12-01T22:30:21.950134
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)C(=O)N(c2ccc(-c3ccco3)cc2)[C@H]1c1ccccc1OCC1CC1

BIRTHDAY: 2018-12-01T22:30:21.960810
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C26H27N3O4

SMILES: COc1cccc([C@]23CC(=O)N(c4ccccc4-c4ccco4)[C@@H]2C(C(C)(C)CO)=NN3)c1

BIRTHDAY: 2018-12-01T22:30:21.972091
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@H]1[C@H](c2ccc(OC3(C)CC3)cc2)C(=O)C(=O)N1c1ccccc1-c1ccco1

BIRTHDAY: 2018-12-01T22:30:22.029239
ATC: G04B
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- UROLOGICALS
Synthesis Plan
FORMULA:C26H25N3O4

SMILES: COc1cccc([C@@H]2C(=O)N(c3ccccc3-c3ccco3)c3n[nH]c(C(C)(C)CO)c32)c1

BIRTHDAY: 2018-12-01T22:30:22.050367
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C25H23N3O5

SMILES: COc1cccc([C@]23CN(c4ccccc4-c4ccoc4)C(=O)[C@@]2([C@H](C)C(=O)O)C=NN3)c1

BIRTHDAY: 2018-12-01T22:30:22.072907
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C28H27NO5

SMILES: CC(C)C(=O)[C@H]1C(=O)N(c2ccc(-c3ccco3)cc2)C(=O)[C@H]1c1ccccc1OCC1CC1

BIRTHDAY: 2018-12-01T22:30:22.083043
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H25NO6

SMILES: CC(C)C(=O)[C@H]1[C@H](c2ccc(OCCO)cc2)C(=O)C(=O)N1c1cccc(-c2ccco2)c1

BIRTHDAY: 2018-12-01T22:30:22.105011
ATC: C04A
- CARDIOVASCULAR SYSTEM
- PERIPHERAL VASODILATORS
- PERIPHERAL VASODILATORS
Synthesis Plan