matter.farm

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

These compounds may interact with:

Calpain-1 catalytic subunit

Potentially involved in: neurodegenerative disease; hereditary spastic paraplegia; carcinoma; mucoepidermoid carcinoma; presbyopia; melanoma; optic neuritis; atopic dermatitis; atypical teratoid / rhabdoid tumor; diabetes mellitus; interstitial cystitis; osteosarcoma; neoplasms; spastic paraplegia 76, autosomal recessive

Disease data sourced from Pharos.

Unknown Action

FORMULA:C39H47N5O7S

SMILES: C[C@H](c1cc2ccc1OCCCCCCNCC2=O)[C@H]1N[C@@](N)([C@@H](C)NC(=O)[C@@H](Cc2ccccc2)NC(=O)OCc2ccccc2)SC(=O)C1=O

BIRTHDAY: 2018-12-01T14:11:27.506638
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C28H34N6O2

SMILES: CC(C)C[C@H](NC(=O)[C@H]1CNCCOc2cccc3ncc(nc23)-c2cccc3cn1nc23)C(C)C

BIRTHDAY: 2018-12-01T14:11:27.517531
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H36N2

SMILES: CC(C)C[C@@H](NC1=CC=CN(CC(C)(C)C)CC1)C(C)C

BIRTHDAY: 2018-12-01T14:11:27.523792
ATC: N06D
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTI-DEMENTIA DRUGS
Synthesis Plan
FORMULA:C20H37N3O4

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

BIRTHDAY: 2018-12-01T14:11:27.532500
ATC: A10A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- INSULINS AND ANALOGUES
Synthesis Plan
FORMULA:C26H28N2O2

SMILES: O=C(CCCCCCC(=O)Nc1ccc(-c2ccccc2)cc1)Nc1ccccc1

BIRTHDAY: 2018-12-01T14:11:27.540551
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H31N3O5

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)C(N)=O

BIRTHDAY: 2018-12-01T14:11:27.550124
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:C20H30N2O4

SMILES: CC(C)C[C@H](C=O)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-12-01T14:11:27.558299
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C34H48N4O3

SMILES: CC(C)C[C@H](CO)NC(=O)[C@@H](CC(C)C)NC1=CCCCc2ccc(o2)C2=NC(=Cc3ccc([nH]3)CCCC1)C=C2

BIRTHDAY: 2018-12-01T14:11:27.569511
ATC: J01C
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- BETA-LACTAM ANTIBACTERIALS, PENICILLINS
Synthesis Plan
FORMULA:C45H60N6O11

SMILES: CC(C)C[C@H](NC(=O)[C@H](C[C@@H]1CC2=C[C@@H](CCc3cc4cc(c3C1)OCCCCOCCCCNC4)OC2=O)NC(=O)CNC(=O)[C@H](NC(=O)c1ccccc1)C(N)=O)C(=O)O

BIRTHDAY: 2018-12-01T14:11:27.587465
ATC: H01A
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- ANTERIOR PITUITARY LOBE HORMONES AND ANALOGUES
Synthesis Plan
FORMULA:C39H54N4O7

SMILES: CC(C)C[C@H](C=O)NC(=O)[C@@H](CC(C)C)NC(=O)O[C@@H]1COCCOCCOCCN2C=C(C=CC3=CN1C14C=CC=CC31C=CC=C4)CC2

BIRTHDAY: 2018-12-01T14:11:27.601754
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C26H41N3O5

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C=O)CC(C)C

BIRTHDAY: 2018-12-01T14:11:27.611834
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H31ClN2O5

SMILES: CC(C)C[C@@H](C)N1[C@H]2CCC[C@H]1C(=O)O[C@H](C(=O)Nc1ccc(Cl)cc1)CC(=O)OC2

BIRTHDAY: 2018-12-01T14:11:27.622563
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis Plan
FORMULA:C20H31N3O4Si

SMILES: CNC(=O)[C@H](NC(=O)[C@H](CC(C)C)N1C(=O)C(=O)[SiH2][C@H]2C=CC=C[C@H]21)C(C)C

BIRTHDAY: 2018-12-01T14:11:27.632127
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H26N2O4

SMILES: O=C[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-12-01T14:11:27.642098
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H42N4O5

SMILES: CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1)C(C)C

BIRTHDAY: 2018-12-25T02:03:30.539528
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:C25H23NO7

SMILES: C[C@@H](NC(=O)c1ccccc1O)Oc1ccccc1C(=O)[C@@H](C)C(=O)c1cccc(O)c1O

BIRTHDAY: 2018-12-25T02:03:30.549864
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C17H29N5O4

SMILES: C[c-]1nnc(COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C=O)CC(C)C)[nH+]1

BIRTHDAY: 2018-12-25T02:03:30.559443
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C20H36N4O4

SMILES: CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N1N=CO[C@@]1(C)C(C)C

BIRTHDAY: 2018-12-25T02:03:30.569133
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:C18H28N2O4

SMILES: CC(C)C[C@H](NC(=O)[C@@]1(C#N)C[C@H]2CCCCCC[C@H]1O2)C(=O)O

BIRTHDAY: 2018-12-25T02:03:30.595874
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C26H26N2O4

SMILES: O=C[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-12-25T02:03:30.614374
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C24H40N2S

SMILES: CC(C)C[C@@H](NC1=CN(Cc2ccc(C(C)(C)C)cc2)CCCS1)C(C)C

BIRTHDAY: 2018-12-25T02:03:30.638870
ATC: P03B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ECTOPARASITICIDES, INCL. SCABICIDES, INSECTICIDES AND REPELLENTS
- INSECTICIDES AND REPELLENTS
Synthesis Plan
FORMULA:C20H37N3O4

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

BIRTHDAY: 2018-12-25T02:03:30.647651
ATC: A10A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- INSULINS AND ANALOGUES
Synthesis Plan
FORMULA:C22H34N2O5

SMILES: CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)C(C)(C)O)C(C)C

BIRTHDAY: 2018-12-03T02:39:35.818801
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H43N5O6

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

BIRTHDAY: 2018-12-03T02:39:35.838530
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C23H43N5O6

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

BIRTHDAY: 2018-12-03T02:39:35.849472
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C24H29N3O3S2

SMILES: CC(C)C[C@@H](NC(=O)[C@H](C)C[C@]12C=CC=C[C@]1(C)SN=C1c3ccccc3SN12)C(=O)O

BIRTHDAY: 2018-12-03T02:39:35.860087
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis Plan
FORMULA:C17H16O6

SMILES: COc1ccc(O)c(C(=O)[C@@H](C)C(=O)c2cccc(O)c2O)c1

BIRTHDAY: 2018-12-03T02:39:35.868463
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C23H23NO8

SMILES: COc1ccc2c(c1C(=O)CCC(=O)c1ccc(O)c(O)c1)[C@@H]1N[C@H](C2)[C@@]1(CO)C(=O)O

BIRTHDAY: 2018-12-03T02:39:35.878987
ATC: N04B
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- DOPAMINERGIC AGENTS
Synthesis Plan
FORMULA:C22H34N2O5

SMILES: CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C(=O)C(C)(C)O)C(C)C

BIRTHDAY: 2018-12-03T02:39:35.887918
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H42N4O5

SMILES: CNC(=O)[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1)C(C)C

BIRTHDAY: 2018-12-03T02:39:35.898490
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:C56H61FN8O

SMILES: CC(C)Cc1nnc(-c2ccc(-c3cc4c5c(c3CCCCCCCCCC4)CNCc3cccc(c3)Nc3nccc(n3)-c3cccc(c3)OCC5)cc2)c(NCc2ccccc2F)n1

BIRTHDAY: 2018-12-03T02:39:35.916763
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C28H31Cl2N3O3

SMILES: N[C@@]1(c2ccccc2)N[C@H](O)[C@@](c2ccccc2)(c2cccc(Cl)c2Cl)CCNCCCOCC1=O

BIRTHDAY: 2018-11-30T03:41:31.877025
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis plan pending
FORMULA:C26H26N2O4

SMILES: O=C[C@@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-11-30T03:41:31.895178
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H32N4O4S

SMILES: CC(C)C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1)C1=CNSC(=O)N1

BIRTHDAY: 2018-11-30T03:41:31.905058
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C26H27N3O4

SMILES: COc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)C(N)=O)c1

BIRTHDAY: 2018-11-30T03:41:31.933140
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis plan pending
FORMULA:C22H33N3O5

SMILES: CNC(=O)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1

BIRTHDAY: 2018-11-30T03:41:31.942727
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:C21H20O3

SMILES: COc1ccc(C(=O)C2=CC[C@H]3C[C@@H]2Cc2c(O)cccc23)cc1

BIRTHDAY: 2018-11-30T03:41:31.966743
ATC: S01X
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OTHER OPHTHALMOLOGICALS
Synthesis plan pending
FORMULA:C20H37N3O4

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

BIRTHDAY: 2018-11-30T03:41:31.975339
ATC: A10A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- INSULINS AND ANALOGUES
Synthesis plan pending
FORMULA:C16H25N3O2S

SMILES: C[C@H]1CCCC=CC=CCCCC[C@@H](n2sc(=O)nc2N)O1

BIRTHDAY: 2018-11-30T03:41:31.991467
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis plan pending
FORMULA:C27H33N3O2

SMILES: CC(C)CC(=O)NC1=CC2=NC1=Cc1ccc([nH]1)CCCCC=CCCCc1ccc2o1

BIRTHDAY: 2018-11-19T08:16:08.169856
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C20H28FN3OS2

SMILES: NCCCNC(=O)[C@@H]1CC[C@]23CCCC[C@H]1N2[C@@H](c1ccc(F)cc1)SS3

BIRTHDAY: 2018-11-19T08:16:08.179295
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C21H35N5O5

SMILES: CC(C)C[C@H](NC(=O)C[C@@]1(C)CNCNc2cncc(n2)OCC(=O)CCO1)[C@@H](C)O

BIRTHDAY: 2018-11-19T08:16:08.189692
ATC: A07A
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ANTIINFECTIVES
Synthesis plan pending
FORMULA:C19H26Cl2N2

SMILES: CC(C)[C@@]1(C)[C@H]2C[C@H]3CN(CCN1C3)[C@@H]2c1cc(Cl)cc(Cl)c1

BIRTHDAY: 2018-11-19T08:16:08.198134
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis plan pending
FORMULA:C32H39N5

SMILES: CC(C)C[C@H](C(C)C)N1c2cccc(c2)CNCC=CCCn2ccc3ccc(cc32)-c2ccnc1n2

BIRTHDAY: 2018-11-19T08:16:08.208545
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C30H39N3O4

SMILES: CN[C@H](C(=O)N[C@H](CC(C)C)C(=O)C(C)C)C1=N[C@H](Cc2ccccc2)[C@@H](Cc2ccccc2)C(=O)O1

BIRTHDAY: 2018-11-19T08:16:08.219757
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis plan pending
FORMULA:C44H57N5O2

SMILES: CC(C)C[C@]1(Nc2c3cccc2Oc2ccc(cc2)C[C@H]2C=CC=C[C@H]2Cc2ccc(cc2)CC3)[C@H]2CNCCNCCNCCN[C@H]1C(=O)C2

BIRTHDAY: 2018-11-19T08:16:08.237160
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis plan pending
FORMULA:C17H16O6

SMILES: COc1ccc(O)c(C(=O)[C@@H](C)C(=O)c2c(O)cccc2O)c1

BIRTHDAY: 2018-11-19T08:16:08.245754
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis plan pending
FORMULA:C21H31N3O5

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)C(N)=O

BIRTHDAY: 2018-11-19T08:16:08.255439
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:C29H40N4O5

SMILES: CNC(=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(C)C

BIRTHDAY: 2018-11-19T08:16:08.266915
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C16H11F4N3O2S

SMILES: O=C(Nc1c(F)cccc1F)[C@@H]1NN=S=C1c1ccc(OC(F)F)cc1

BIRTHDAY: 2018-11-19T08:16:08.286039
ATC: A03A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
Synthesis plan pending
FORMULA:C20H37N3O4

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

BIRTHDAY: 2018-11-19T08:16:08.294858
ATC: A10A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- INSULINS AND ANALOGUES
Synthesis plan pending
FORMULA:C19H15NO7

SMILES: COc1cc2c(cc1C(=O)CCC(=O)c1ccc(O)c(O)c1)C(=O)NC2=O

BIRTHDAY: 2018-11-19T08:16:08.304122
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis plan pending
FORMULA:C27H29FN4O3

SMILES: COc1ccc([C@H]2[C@H](C(N)=O)CC(=O)Nc3cccc(c3)NCCN2Cc2ccc(F)cc2)cc1

BIRTHDAY: 2018-11-19T08:16:08.316196
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C17H19F3N4O3

SMILES: CC(C)C[C@@H](Nc1n[nH]c(=O)n(Cc2ccccc2)c1=O)C(=O)C(F)(F)F

BIRTHDAY: 2018-11-19T08:16:08.344985
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C22H29NO5

SMILES: CC(C)[C@H](NC(=O)[C@]12O[C@]3(C(C)(C)C)[C@H]4[C@@H]5C(=O)[C@H]([C@@H]6[C@H]1[C@@H]3[C@@]65C)[C@@H]42)C(=O)O

BIRTHDAY: 2018-11-19T08:16:08.355024
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C27H35N3O5

SMILES: CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C(=O)C(=O)NCc1ccccc1)C(C)C

BIRTHDAY: 2018-11-19T08:16:08.365496
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C26H33N3O4

SMILES: COc1ccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)NCCCCN2CCCC2=O)cc1

BIRTHDAY: 2018-11-19T08:16:08.375362
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis plan pending
FORMULA:C35H46N6O6

SMILES: CC(C)C[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)Oc1c2ccc3cccc(c13)CNCCNCC(=O)NCc1cccc(c1)O2)C(N)=O

BIRTHDAY: 2018-11-19T08:16:08.389716
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis plan pending
FORMULA:C30H52N2O5

SMILES: CC(C)C[C@H](NC(=O)O[C@@H]1CC=CCCCCOC(=O)C=C(C(C)C)C1)C(=O)N[C@@H](CC(C)C)C(C)C

BIRTHDAY: 2018-11-19T08:16:08.409691
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis plan pending
FORMULA:C26H42N4O5

SMILES: CNC(=O)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(C)C

BIRTHDAY: 2018-11-19T08:16:08.420999
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:C21H22N2O5

SMILES: COc1ccccc1C(=O)[C@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(N)=O

BIRTHDAY: 2018-11-19T08:16:08.430873
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C20H21NO4S

SMILES: O=C[C@H](Cc1ccccc1)NC(=O)[C@@]1(c2ccccc2)CCCS1(=O)=O

BIRTHDAY: 2018-11-19T08:16:08.440023
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis plan pending
FORMULA:C21H21N3O3S

SMILES: Cc1sccc1C(=O)N[C@H](Cc1ccccc1)C(=O)Nc1c[nH]c(=O)c(C)c1

BIRTHDAY: 2018-11-19T08:16:08.449400
ATC: N06B
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
Synthesis plan pending
FORMULA:C17H16O6

SMILES: COc1cc(C(=O)CCC(=O)c2ccc(O)c(O)c2)ccc1O

BIRTHDAY: 2018-11-19T08:16:08.457349
ATC: R05C
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- EXPECTORANTS, EXCL. COMBINATIONS WITH COUGH SUPPRESSANTS
Synthesis plan pending
FORMULA:C17H16O6

SMILES: COc1ccc(O)cc1C(=O)[C@H](C)C(=O)c1c(O)cccc1O

BIRTHDAY: 2018-11-19T08:16:08.465716
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:C27H28N2O4

SMILES: COc1ccccc1C(=O)[C@H](C)C(=O)Nc1cccc(C(=O)Nc2ccccc2C(C)C)c1

BIRTHDAY: 2018-11-19T08:16:08.475705
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C22H37N3O6

SMILES: CC(C)C[C@H](NC(=O)O[C@H]1OC=NC(C)(C)C1=O)C(=O)N[C@H](CC(C)C)C(=O)C(C)C

BIRTHDAY: 2018-11-19T08:16:08.496235
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis plan pending
FORMULA:C27H28N2O4

SMILES: COc1ccccc1C(=O)CCC(=O)Nc1ccccc1C(=O)Nc1cccc(C(C)C)c1

BIRTHDAY: 2018-11-19T08:16:08.514416
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis plan pending
FORMULA:C20H24N2O2

SMILES: CC(C)(C(=O)Nc1ccccc1)C(C)(C)C(=O)Nc1ccccc1

BIRTHDAY: 2018-11-19T08:16:08.531204
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis plan pending
FORMULA:C24H30F3N5O4

SMILES: CNC(=O)[C@@H](C(=O)N[C@H](C#N)C(C)C)[C@H]1C[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H]2COC[C@H]1N2

BIRTHDAY: 2018-11-19T08:16:08.543136
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis plan pending
FORMULA:C20H37N3O4

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

BIRTHDAY: 2018-11-30T17:23:53.500552
ATC: A10A
- ALIMENTARY TRACT AND METABOLISM
- DRUGS USED IN DIABETES
- INSULINS AND ANALOGUES
Synthesis Plan
FORMULA:C20H21NO3

SMILES: O=C[C@@H](Cc1ccccc1)NC(=O)[C@@]1(Cc2ccccc2)CCO1

BIRTHDAY: 2018-11-30T17:23:53.561887
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C26H39N3O4

SMILES: CC(C)C[C@@H](C=O)NC(=O)[C@@H](CC(C)C)NC(=O)O[C@H]1C[C@H]2CC[C@H]1N2Cc1ccccc1

BIRTHDAY: 2018-11-30T17:23:53.571707
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C19H29IN2O3

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CI)C(C)C

BIRTHDAY: 2018-11-30T17:23:53.579764
ATC: A14A
- ALIMENTARY TRACT AND METABOLISM
- ANABOLIC AGENTS FOR SYSTEMIC USE
- ANABOLIC STEROIDS
Synthesis Plan
FORMULA:C25H35N5O

SMILES: CC(C)Cc1ccc2cc1CNCC=CCOC[C@H]1CCCN(C1)c1ccnc(n1)N2

BIRTHDAY: 2018-11-30T17:23:53.589027
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:C25H23NO7

SMILES: O=C(CCC(=O)c1ccc(O)c(O)c1)c1ccc(OCCNC(=O)c2ccc(O)cc2)cc1

BIRTHDAY: 2018-11-30T17:23:53.598610
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C25H23NO7

SMILES: C[C@@H](NC(=O)c1cccc(O)c1)Oc1ccccc1C(=O)[C@@H](C)C(=O)c1cccc(O)c1O

BIRTHDAY: 2018-12-02T16:07:01.406389
ATC: M02A
- MUSCULO-SKELETAL SYSTEM
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
- TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
Synthesis Plan
FORMULA:C27H35N3O5

SMILES: CC(C)C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)C(=O)NCc1ccccc1)C(C)C

BIRTHDAY: 2018-12-02T16:07:01.416836
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H34N6O5S

SMILES: CC(C)C[C@H](NC(=O)[C@H](Cc1nnc(-c2ccccc2)s1)NC(=O)[C@@H](Cc1ccccc1)NCC(=O)O)C(N)=O

BIRTHDAY: 2018-12-02T16:07:01.429342
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C27H28N2O4

SMILES: COc1ccccc1C(=O)[C@@H](C)C(=O)Nc1cccc(C(=O)Nc2ccccc2C(C)C)c1

BIRTHDAY: 2018-12-02T16:07:01.439224
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H31FN4O2

SMILES: CC(C)CC(=O)N[C@H]1NCCc2cn(cn2)CC=C([C@@H](C)F)COc2ccc1cc2

BIRTHDAY: 2018-12-02T16:07:01.448724
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C17H16O6

SMILES: COc1cccc(C(=O)[C@H](C)C(=O)c2cccc(O)c2O)c1O

BIRTHDAY: 2018-12-02T16:07:01.465074
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C25H32N2O8

SMILES: CC(C)C[C@@H](NC(=O)O[C@@]12OC(=O)[C@@H](O1)C(=O)c1ccccc12)C(=O)N[C@H](C(=O)C(C)C)C(C)C

BIRTHDAY: 2018-12-02T16:07:01.484441
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C25H34N4O4

SMILES: COc1ccc(C[C@@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]2CC[C@@]3(C)C=C(C#N)N2C3)cc1OC

BIRTHDAY: 2018-12-02T16:07:01.503094
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C23H27NO5

SMILES: COc1ccccc1C(=O)[C@H](C)C(=O)N[C@H](Cc1ccccc1)C(=O)C(C)(C)O

BIRTHDAY: 2018-12-02T16:07:01.512077
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C27H28N2O4

SMILES: COc1ccc(C(=O)CCC(=O)Nc2ccccc2C(=O)Nc2ccc(C(C)C)cc2)cc1

BIRTHDAY: 2018-12-03T10:43:23.495876
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C17H16O5

SMILES: COc1ccc(C(=O)CCC(=O)c2ccc(O)c(O)c2)cc1

BIRTHDAY: 2018-12-03T10:43:23.503275
ATC: A01A
- ALIMENTARY TRACT AND METABOLISM
- STOMATOLOGICAL PREPARATIONS
- STOMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C35H44N2O3

SMILES: CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)c1cc2ccc1CCc1ccc(cc1)CC2

BIRTHDAY: 2018-12-03T10:43:23.515759
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H25N3O5

SMILES: CC(C)[C@]1(C)N=C(C(=O)OC(C)(C)c2ccccc2)C=NC(=O)[C@H]1C(=O)NO

BIRTHDAY: 2018-12-03T10:43:23.534038
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C17H18N4O6S

SMILES: N[C@@H](CC(=O)O)C(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(=O)sc(O)n1

BIRTHDAY: 2018-12-03T10:43:23.552321
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C30H36N6O2

SMILES: CC(C)C[C@H](C=O)NC(=O)[C@@H](CC(C)C)Nc1ccc2cc1C=Cc1cccc(c1)Nc1ccnc(n1)N2

BIRTHDAY: 2018-12-03T10:43:23.574402
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C15H27N5O6

SMILES: CC(C)C[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)O[C@]1(N)C=NON1)C(=O)O

BIRTHDAY: 2018-12-03T19:11:48.223245
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H22BNO5

SMILES: C[C@H](C(=O)c1cccc(OCC(=O)NCc2ccccc2)c1)C1=CB(O)OC1

BIRTHDAY: 2018-12-03T19:11:48.232349
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C17H16O6

SMILES: COc1c(O)cccc1C(=O)[C@@H](C)C(=O)c1cccc(O)c1O

BIRTHDAY: 2018-12-03T19:11:48.249441
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C17H16O6

SMILES: COc1ccc(O)cc1C(=O)[C@@H](C)C(=O)c1cccc(O)c1O

BIRTHDAY: 2018-12-03T19:11:48.298621
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C23H45N7O4

SMILES: CCNC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)N[C@]1(C)NNC(=O)N1

BIRTHDAY: 2018-12-03T19:11:48.319917
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C17H16O6

SMILES: COc1ccc(O)c(C(=O)[C@H](C)C(=O)c2cccc(O)c2O)c1

BIRTHDAY: 2018-12-01T22:30:54.231865
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C36H51N5O3

SMILES: CC(C)C[C@H](CO)NC(=O)[C@@H](CC(C)C)Nc1ccc2cc1Oc1ccc3cccc(c3c1)N1CC[C@@H](C1)NCCCNC2

BIRTHDAY: 2018-12-01T22:30:54.263333
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C25H23NO7

SMILES: C[C@H](NC(=O)c1ccccc1O)Oc1ccccc1C(=O)[C@H](C)C(=O)c1cccc(O)c1O

BIRTHDAY: 2018-12-01T22:30:54.273630
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C25H23NO7

SMILES: C[C@H](C(=O)c1ccccc1O[C@H](C)NC(=O)c1ccccc1O)C(=O)c1cccc(O)c1O

BIRTHDAY: 2018-12-01T22:30:54.301805
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan