matter.farm

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

These compounds may interact with:

Leucine-rich repeat serine/threonine-protein kinase 2

Potentially involved in: neurodegenerative disease; parkinson's disease; crohn's disease; melanoma; ovarian cancer; kidney cancer; carcinoma; skin cancer; large intestine cancer; movement disease; dementia; leprosy; multiple system atrophy; rem sleep behavior disorder; alzheimer's disease; toxic encephalopathy; renal cell carcinoma; endometriosis; nerve degeneration; parkinson disease

Disease data sourced from Pharos.

Inhibitor

FORMULA:C21H19F4N5

SMILES: C[C@H](C#Cc1ccncc1F)Nc1nc2c(c(NC3CC3)n1)[C@H](C(F)(F)F)CC=C2

BIRTHDAY: 2018-12-01T14:11:29.863141
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C20H25N7S

SMILES: CSc1nc(-c2ccncc2N[C@@H]2NCCC[C@@]2(N)c2ccccc2)[nH]c1N

BIRTHDAY: 2018-12-01T14:11:29.875286
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C16H21N5O

SMILES: COc1ccccc1[C@H]1N(C(C)(C)C)N=C2N=CN=C[C@@]21N

BIRTHDAY: 2018-12-01T14:11:29.884065
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis Plan
FORMULA:C18H20F3N5O3

SMILES: CNc1cnc(C(F)(F)F)nc1Nc1cccc(C(=O)N2CCOCC2)c1OC

BIRTHDAY: 2018-12-01T14:11:29.894423
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H29N7O

SMILES: CC(C)n1cnc2c(NCc3cccnc3)nc(NC(C)(C)C(C)(C)O)nc21

BIRTHDAY: 2018-12-01T14:11:29.903798
ATC: B01A
- BLOOD AND BLOOD FORMING ORGANS
- ANTITHROMBOTIC AGENTS
- ANTITHROMBOTIC AGENTS
Synthesis Plan
FORMULA:C13H9F3N4S

SMILES: CSc1c(C#N)ncnc1Nc1ccccc1C(F)(F)F

BIRTHDAY: 2018-12-01T14:11:29.912348
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C26H25N5O3

SMILES: COc1ccc(-c2cc(C(=O)Nc3ccc(-c4ccc(N5CCOCC5)nc4)cc3)n[nH]2)cc1

BIRTHDAY: 2018-12-01T14:11:29.922435
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C17H19F5N4O

SMILES: COc1c(Nc2ncnc(C(F)(F)F)c2N[C@@H](C)C(C)C)ccc(F)c1F

BIRTHDAY: 2018-12-01T14:11:29.932412
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H29N7O

SMILES: CC(C)n1cnc2nc(NCc3ccncc3)nc(NC(C)(C)C(C)(C)O)c21

BIRTHDAY: 2018-12-01T14:11:29.941895
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C16H23F3N6

SMILES: Cc1cc(Nc2ncc(C(F)(F)F)c(NC(C)C)n2)n(C(C)(C)C)n1

BIRTHDAY: 2018-12-01T14:11:29.951321
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis Plan
FORMULA:C24H22N4O2

SMILES: Cc1cc(Nc2cccnc2-c2ccccc2C#N)cc(C(=O)N2CCOCC2)c1

BIRTHDAY: 2018-12-01T14:11:29.960452
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C13H15F3N8

SMILES: CNc1cnc(C(F)(F)F)nc1Nc1[nH]nc(N)c1C(C)(C)C#N

BIRTHDAY: 2018-12-01T14:11:29.970319
ATC: N04B
- NERVOUS SYSTEM
- ANTI-PARKINSON DRUGS
- DOPAMINERGIC AGENTS
Synthesis Plan
FORMULA:C18H19N7S

SMILES: C[C@@H](Nc1cnc(Nc2ccc3c(c2)[SH]=NCN3)nc1)c1cccnc1

BIRTHDAY: 2018-12-01T14:11:29.979751
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C14H16F3N7

SMILES: CNc1nc(Nc2cn(C)nc2C(C)(C)C#N)ncc1C(F)(F)F

BIRTHDAY: 2018-12-01T14:11:30.009188
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C21H15N5

SMILES: N#Cc1cccc(-c2ccc(Nc3cccc(-c4cn[nH]c4)c3)nc2)c1

BIRTHDAY: 2018-12-25T02:03:32.686092
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H30N6O

SMILES: CC[C@@](C)(Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1)[C@H](C)O

BIRTHDAY: 2018-12-25T02:03:32.695525
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C28H34N10OS

SMILES: CC(C)Nc1nc(NCc2ccccn2)nc2nc3n(c12)CCCOCCNC[C@H]1CSC(=N1)c1ccnc-3c1

BIRTHDAY: 2018-12-25T02:03:32.708577
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C20H29N7O

SMILES: CC(C)n1cnc2nc(NCc3ccccn3)nc(NC(C)(C)C(C)(C)O)c21

BIRTHDAY: 2018-12-25T02:03:32.727581
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C23H17ClF3N3O3

SMILES: C=C(C(=O)Nc1ccc(C(=O)Nc2ccncc2Cl)cc1)c1cc(OC)ccc1C(F)(F)F

BIRTHDAY: 2018-12-25T02:03:32.738416
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C20H21F3N8O2

SMILES: CNc1c(Nc2cccc(-c3n[nH]cc3N)c2C(=O)N2CCOCC2)ncnc1C(F)(F)F

BIRTHDAY: 2018-12-25T02:03:32.751078
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C23H16N4

SMILES: N#Cc1cccc(-c2ccc(Nc3cccc(-c4cccnc4)c3)nc2)c1

BIRTHDAY: 2018-12-25T02:03:32.759270
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H22N8O2

SMILES: COc1cccc(-c2nn(C(C)(C)C(=O)Nc3cnn(C)c3)c3ncnc(N)c23)c1

BIRTHDAY: 2018-12-25T02:03:32.779324
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H24F3N5O3

SMILES: COc1cc(C(=O)N2CCOCC2)ccc1Nc1ncc(C(F)(F)F)c(NC(C)C)n1

BIRTHDAY: 2018-12-25T02:03:32.799744
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C23H16N4

SMILES: N#Cc1ccccc1-c1ncccc1Nc1ccccc1-c1ccccn1

BIRTHDAY: 2018-12-25T02:03:32.817823
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C22H25F3N8S

SMILES: CC(C)n1cnc2c(NCc3ccccn3)nc(N[C@](C)([C@H]3C=CSC=CN3)C(F)(F)F)nc21

BIRTHDAY: 2018-12-25T02:03:32.830819
ATC: V03A
- VARIOUS
- ALL OTHER THERAPEUTIC PRODUCTS
- ALL OTHER THERAPEUTIC PRODUCTS
Synthesis Plan
FORMULA:C18H19N3O3

SMILES: COc1cccc([C@]2(c3ccccc3OC)C=NN(C(N)=O)C2)c1

BIRTHDAY: 2018-12-25T02:03:32.849232
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C18H20F3N5O3

SMILES: CNc1ncc(Nc2cccc(OC)c2C(=O)N2CCOCC2)c(C(F)(F)F)n1

BIRTHDAY: 2018-12-25T02:03:32.859936
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C15H13F3N2

SMILES: FC(F)(F)c1ccccc1-c1ccncc1NC1CC1

BIRTHDAY: 2018-12-03T02:39:38.148318
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C30H32N4O2

SMILES: COc1ccccc1-c1[nH]ncc1C(=O)Nc1cccc2c1NCCCc1cccc(c1)CCCC2

BIRTHDAY: 2018-12-03T02:39:38.175147
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C16H21N5O

SMILES: COc1ccc([C@@]23C=NC=N[C@]2(N)N(C(C)(C)C)N=C3)cc1

BIRTHDAY: 2018-12-03T02:39:38.183391
ATC: B03A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIANEMIC PREPARATIONS
- IRON PREPARATIONS
Synthesis Plan
FORMULA:C19H24FN7O3S2

SMILES: CNc1c(Nc2cccc(OC)c2C(=O)N2CCOCC2)ncnc1[C@]1(F)[SH]=NS[C@H]1N

BIRTHDAY: 2018-12-03T02:39:38.195017
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C23H16N4

SMILES: N#Cc1ccccc1-c1ccc(Nc2ccccc2-c2ccccn2)cn1

BIRTHDAY: 2018-12-03T02:39:38.203187
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C17H19F5N4O

SMILES: COc1c(F)ccc(Nc2ncnc(C(F)(F)F)c2N[C@H](C)C(C)C)c1F

BIRTHDAY: 2018-12-03T02:39:38.213052
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H19N3O3

SMILES: COc1ccc(C2=NN(C(N)=O)[C@H](c3ccc(OC)cc3)C2)cc1

BIRTHDAY: 2018-12-03T02:39:38.230735
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H20F5N5O2

SMILES: C[C@H](Nc1c(N[C@@H]2CCCCO2)ncnc1C(F)(F)F)C(=O)Nc1cccc(F)c1F

BIRTHDAY: 2018-12-03T02:39:38.242178
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C15H13F3N2

SMILES: FC(F)(F)c1ccc(-c2cccc(NC3CC3)n2)cc1

BIRTHDAY: 2018-12-03T02:39:38.269249
ATC: D02B
- DERMATOLOGICALS
- EMOLLIENTS AND PROTECTIVES
- PROTECTIVES AGAINST UV-RADIATION
Synthesis Plan
FORMULA:C26H17F3N6

SMILES: N#Cc1ccccc1-c1ccncc1Nc1ccccc1-c1ccnc2cnn(CC(F)(F)F)c12

BIRTHDAY: 2018-11-30T03:41:34.208280
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis plan pending
FORMULA:C27H22F3N7O

SMILES: FC(F)(F)c1cccnc1Nc1cccc(-c2cc3c(cn2)cnn3-c2cccc(N3CCOCC3)n2)c1

BIRTHDAY: 2018-11-30T03:41:34.229628
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H13F6N3S

SMILES: CSc1nc(Nc2cccc(C(F)(F)F)c2)cc(-c2ccccc2C(F)(F)F)n1

BIRTHDAY: 2018-11-30T03:41:34.249290
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis plan pending
FORMULA:C33H53N7O9

SMILES: CC(C)Nc1nc(NCc2ccncc2)nc2ncn([C@@]3(C)COCCOCCOCCOCCOCCOCCOCCOCCO3)c12

BIRTHDAY: 2018-11-30T03:41:34.282918
ATC: P01A
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
Synthesis plan pending
FORMULA:C19H20N6O

SMILES: COc1ccccc1-c1c[nH]nc1Nc1ncc2cc(C(C)C)[nH]c2n1

BIRTHDAY: 2018-11-30T03:41:34.301994
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C20H23N9O

SMILES: CC1=[N+]([O-])CN(c2nc3nc(NC(C)C)nc(NCc4ccccc4C#N)c3[nH]2)C1

BIRTHDAY: 2018-11-30T03:41:34.351615
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:C20H29N7O

SMILES: CC(C)n1cnc2nc(NC(C)(C)C(C)(C)O)nc(NCc3ccncc3)c21

BIRTHDAY: 2018-11-30T03:41:34.360880
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C18H19N3O3

SMILES: COc1ccc(C2=NN(C(N)=O)[C@@H](c3ccc(OC)cc3)C2)cc1

BIRTHDAY: 2018-11-30T03:41:34.378409
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C35H67N17S2

SMILES: CNc1nc(Nc2cnn3c2CNCCNCCNCC2(CC2)NCCNCCNCCNCCCSSCCNCCNCCNCC3)ncc1C#N

BIRTHDAY: 2018-11-19T08:18:06.007104
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C14H20F3N5O2

SMILES: CNC(=O)[C@@H](C)Nc1nc(NC2CCOCC2)ncc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:18:06.017066
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis plan pending
FORMULA:C22H28F3N5O3

SMILES: COc1cc(C(=O)N2CCOCC2)ccc1Nc1ncc(C(F)(F)F)c(N[C@H](C)C(C)C)n1

BIRTHDAY: 2018-11-19T08:18:06.028086
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C23H23FN4O

SMILES: Fc1ccc(-c2ccc(NC3CC3)nc2-c2ccc(N3CCOCC3)nc2)cc1

BIRTHDAY: 2018-11-19T08:18:06.037291
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C25H30N2O2S2

SMILES: COc1ccccc1[C@H]1N=C(N2CCCCCCCc3cccc(c3)CC(=O)C2)SS1

BIRTHDAY: 2018-11-19T08:18:06.054969
ATC: S02D
- SENSORY ORGANS
- OTOLOGICALS
- OTHER OTOLOGICALS
Synthesis plan pending
FORMULA:C26H29F6N7

SMILES: CNc1c(Nc2c3cccc2[C@](N)(C(F)(F)F)NCCc2ccc(cc2)CCCCN3)ncnc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:18:06.068269
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis plan pending
FORMULA:C18H15N9

SMILES: C[C@H](Nc1ncc(C#N)c(Nc2ccc(C#N)cc2)n1)c1cnc(N)cn1

BIRTHDAY: 2018-11-19T08:18:06.078525
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis plan pending
FORMULA:C21H31N7O

SMILES: CC[C@](C)(Nc1nc(NCc2cccnc2)c2ncn(C(C)C)c2n1)C(C)(C)O

BIRTHDAY: 2018-11-19T08:18:06.097768
ATC: G04B
- GENITO URINARY SYSTEM AND SEX HORMONES
- UROLOGICALS
- UROLOGICALS
Synthesis plan pending
FORMULA:C18H20F3N5O3

SMILES: CNc1c(Nc2cccc(C(=O)N3CCOCC3)c2OC)ncnc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:18:06.108008
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H22F3N5O3

SMILES: CNc1nc(Nc2ccc(C(=O)N3CCOC[C@@H]3C)cc2OC)ncc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:18:06.118740
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C26H25N5O3

SMILES: COc1cccc(-c2[nH]ncc2C(=O)Nc2ccc(-c3cccc(N4CCOCC4)n3)cc2)c1

BIRTHDAY: 2018-11-19T08:18:06.129115
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C16H16N4O2

SMILES: COc1ccc([C@H]2CC(c3cccnc3)=NN2C(N)=O)cc1

BIRTHDAY: 2018-11-19T08:18:06.145048
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C18H19N3O3

SMILES: COc1cccc(C2=NN(C(N)=O)C[C@@H]2c2cccc(OC)c2)c1

BIRTHDAY: 2018-11-19T08:18:06.153785
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
FORMULA:C17H28N6O

SMILES: CC(C)n1cnc2nc(NC3CC3)nc(NC(C)(C)C(C)(C)O)c21

BIRTHDAY: 2018-11-19T08:18:06.172324
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C16H21N5O

SMILES: COc1ccccc1[C@H]1N(C(C)(C)C)N=C2N=CN=C[C@]21N

BIRTHDAY: 2018-11-19T08:18:06.181130
ATC: S01B
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFLAMMATORY AGENTS
Synthesis plan pending
FORMULA:C23H20ClN3O4

SMILES: C=C(C(=O)Nc1cccc(C(=O)Nc2ccncc2Cl)c1)c1cccc(OC)c1OC

BIRTHDAY: 2018-11-19T08:18:06.190834
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis plan pending
FORMULA:C19H22F3N5O3

SMILES: CNc1cnc(C(F)(F)F)nc1Nc1cccc(C(=O)N2CCO[C@H](C)C2)c1OC

BIRTHDAY: 2018-11-19T08:18:06.201527
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H20F5N5O2

SMILES: C[C@@H](Nc1nc(NC2CCOCC2)ncc1C(F)(F)F)C(=O)Nc1ccc(F)cc1F

BIRTHDAY: 2018-11-19T08:18:06.213071
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:C27H22F3N7O

SMILES: FC(F)(F)c1ccncc1Nc1ccccc1-c1cnc2cnn(-c3ccncc3N3CCOCC3)c2c1

BIRTHDAY: 2018-11-19T08:18:06.228233
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis plan pending
FORMULA:C18H30N6O

SMILES: CC[C@@](C)(Nc1nc(NC2CC2)nc2ncn(C(C)C)c12)C(C)(C)O

BIRTHDAY: 2018-11-19T08:18:06.237334
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C26H25N5O3

SMILES: COc1cccc(-c2cc(C(=O)Nc3ccc(-c4ccc(N5CCOCC5)nc4)cc3)[nH]n2)c1

BIRTHDAY: 2018-11-19T08:18:06.260053
ATC: C08D
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- SELECTIVE CALCIUM CHANNEL BLOCKERS WITH DIRECT CARDIAC EFFECTS
Synthesis plan pending
FORMULA:C18H19N3O3

SMILES: COc1ccccc1C1(c2ccccc2OC)C=NN(C(N)=O)C1

BIRTHDAY: 2018-11-19T08:18:06.277069
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H20F5N5O2

SMILES: C[C@@H](Nc1c(N[C@H]2CCCCO2)ncnc1C(F)(F)F)C(=O)Nc1cccc(F)c1F

BIRTHDAY: 2018-11-19T08:18:06.298030
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C34H41N11

SMILES: CNc1cnc([C@@H]2CCCCCCCCc3ccc([nH]3)C=C3C=CC(=N3)c3ccc2[nH]3)nc1Nc1c(C(C)(C)C#N)n[nH]c1N

BIRTHDAY: 2018-11-19T08:18:06.311972
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C20H19F6N7

SMILES: CC(C)n1cnc2c(NC(C)(C(F)(F)F)C(F)(F)F)nc(NCc3ccc(C#N)cc3)nc21

BIRTHDAY: 2018-11-19T08:18:06.333343
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis plan pending
FORMULA:C16H20N2O3S

SMILES: CC(C)C(=O)Nc1c(C(=O)N2CCOCC2)sc2c1C=CC2

BIRTHDAY: 2018-11-19T08:18:06.341466
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis plan pending
FORMULA:C23H20ClN3O4

SMILES: C=C(C(=O)Nc1cccc(C(=O)Nc2ccncc2Cl)c1)c1c(OC)cccc1OC

BIRTHDAY: 2018-11-19T08:18:06.360733
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis plan pending
FORMULA:C9H10N4O

SMILES: CNC1=NN2N=CC(=O)C=C[C@H]2C=C1

BIRTHDAY: 2018-11-19T08:18:06.378547
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis plan pending
FORMULA:C29H38N8

SMILES: CC(C)Nc1nc(NCc2ccccn2)c2c(ncn2-c2c3cccc2CCNCCCCCCC3)n1

BIRTHDAY: 2018-11-19T08:18:06.389704
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C18H18ClF3N6O2

SMILES: CNc1cnc(Cl)nc1Nc1cccc(C(F)(F)F)c1C(=O)N1CC[C@H](C(N)=O)C1

BIRTHDAY: 2018-11-19T08:18:06.400927
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C16H16F4N4

SMILES: C[C@H](Nc1cc(C(F)(F)F)nc(NC2CC2)n1)c1ccc(F)cc1

BIRTHDAY: 2018-11-19T08:18:06.410292
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C13H13N3O

SMILES: CN1C[C@@H]2NC(=O)[C@H]1Cc1c(C#N)cccc12

BIRTHDAY: 2018-11-19T08:18:06.427978
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis plan pending
FORMULA:C21H30N6O

SMILES: CC(C)n1cnc2nc(NCc3ccccc3)nc(NC(C)(C)C(C)(C)O)c21

BIRTHDAY: 2018-11-19T08:18:06.437086
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C26H23FN6O

SMILES: N[C@H]1c2ccc(-c3ccc(N4CCOCC4)nc3)cc2-c2ncnc(Nc3ccccc3F)c21

BIRTHDAY: 2018-11-19T08:18:06.447672
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C18H20F3N5O3

SMILES: CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2OC)cc(C(F)(F)F)n1

BIRTHDAY: 2018-11-19T08:18:06.458188
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C23H20F2N6O

SMILES: CC(C)n1c(=O)[nH]c2nc(-c3ccccc3C#N)nc(N[C@@H](C)c3c(F)cccc3F)c21

BIRTHDAY: 2018-11-19T08:18:06.477777
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis plan pending
FORMULA:C13H15N7S2

SMILES: Cc1c(Nc2ncnc(C#N)c2NC(C)C)nn2c1SSC2

BIRTHDAY: 2018-11-19T08:18:06.487039
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C19H18N4O

SMILES: COc1ccc(-c2nn(C(C)C)c3nc4ccccc4nc23)cc1

BIRTHDAY: 2018-11-19T08:18:06.495850
ATC: S01A
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIINFECTIVES
Synthesis plan pending
FORMULA:C16H16N4O2

SMILES: COc1cccc([C@@H]2C=NN(C(N)=O)[C@H]2c2ccccn2)c1

BIRTHDAY: 2018-11-19T08:18:06.507556
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis plan pending
FORMULA:C17H28N6O

SMILES: CC(C)n1cnc2nc(NC(C)(C)C(C)(C)O)nc(NC3CC3)c21

BIRTHDAY: 2018-11-19T08:18:06.518501
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis plan pending
FORMULA:C18H20F3N5O3

SMILES: CNc1c(Nc2cccc(OC)c2C(=O)N2CCOCC2)ncnc1C(F)(F)F

BIRTHDAY: 2018-11-19T08:18:06.528923
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis plan pending
FORMULA:C15H13F3N2

SMILES: FC(F)(F)c1ccc(-c2ccc(NC3CC3)nc2)cc1

BIRTHDAY: 2018-11-19T08:18:06.536258
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis plan pending
FORMULA:C14H17F6N5O

SMILES: C[C@H]1CO[C@@H](Nc2ncnc(C(F)(F)F)c2N[C@H](C)C(F)(F)F)C=CN1

BIRTHDAY: 2018-11-19T08:18:06.546755
ATC: A14A
- ALIMENTARY TRACT AND METABOLISM
- ANABOLIC AGENTS FOR SYSTEMIC USE
- ANABOLIC STEROIDS
Synthesis plan pending
FORMULA:C22H27F4N5O3

SMILES: COc1c(F)ccc(Nc2nc(C(F)(F)F)ncc2N[C@@H](C)C(C)C)c1C(=O)N1CCOCC1

BIRTHDAY: 2018-11-19T08:18:06.558330
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis plan pending
FORMULA:C21H15N5

SMILES: N#Cc1ccc(-c2ccc(Nc3cccc(-c4cc[nH]n4)c3)cn2)cc1

BIRTHDAY: 2018-11-19T08:18:06.575926
ATC: J02A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIMYCOTICS FOR SYSTEMIC USE
- ANTIMYCOTICS FOR SYSTEMIC USE
Synthesis plan pending
FORMULA:C18H20F3N5O2

SMILES: CNc1nc(Nc2cc(C(=O)N3CCOCC3)ccc2C)ncc1C(F)(F)F

BIRTHDAY: 2018-11-30T17:23:55.845933
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H20F3N7O2

SMILES: CNc1c(Nc2cccc(-c3ccn[nH]3)c2C(=O)N2CCOCC2)ncnc1C(F)(F)F

BIRTHDAY: 2018-11-30T17:23:55.857785
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H20F3N5O3

SMILES: CNc1cnc(C(F)(F)F)nc1Nc1cccc(OC)c1C(=O)N1CCOCC1

BIRTHDAY: 2018-11-30T17:23:55.877381
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C25H33N3O2

SMILES: COc1cccc([C@]23C=NC(O)=CC2=NN(C2(C)[C@@H]4CCCCC[C@@H]2CCC4)C3)c1

BIRTHDAY: 2018-11-30T17:23:55.896036
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C18H20F3N5O3

SMILES: CNc1ncc(C(F)(F)F)c(Nc2ccc(C(=O)N3CCOCC3)cc2OC)n1

BIRTHDAY: 2018-11-30T17:23:55.915542
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H17N5O2

SMILES: COc1cccc(-c2cc(C(=O)Nc3ccc(-c4cn[nH]c4)cc3)[nH]n2)c1

BIRTHDAY: 2018-11-30T17:23:55.924268
ATC: N02B
- NERVOUS SYSTEM
- ANALGESICS
- OTHER ANALGESICS AND ANTIPYRETICS
Synthesis Plan
FORMULA:C24H24N6O

SMILES: C[C@@]1(Nc2cnccc2[C@]23C=CC=CC2=NN[C@H]3c2ccccc2C#N)COCCN1

BIRTHDAY: 2018-11-30T17:23:55.934869
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C20H19F6N7

SMILES: CC(C)n1cnc2c(NCc3ccc(C#N)cc3)nc(NC(C)(C(F)(F)F)C(F)(F)F)nc21

BIRTHDAY: 2018-11-30T17:23:55.947375
ATC: N06A
- NERVOUS SYSTEM
- PSYCHOANALEPTICS
- ANTIDEPRESSANTS
Synthesis Plan
FORMULA:C17H19F5N4O

SMILES: COc1cc(F)c(Nc2nc(N[C@H](C)C(C)C)ncc2C(F)(F)F)c(F)c1

BIRTHDAY: 2018-11-30T17:23:55.957074
ATC: V08D
- VARIOUS
- CONTRAST MEDIA
- ULTRASOUND CONTRAST MEDIA
Synthesis Plan
FORMULA:C16H21N5O

SMILES: COc1cccc([C@]23C=NC(N)=NC2=NN(C(C)(C)C)C3)c1

BIRTHDAY: 2018-12-02T16:07:03.729258
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan
FORMULA:C24H29NO4S2

SMILES: C=C(C(=O)Nc1ccccc1C1CSCCCSC1)c1c(OC)ccc(OC)c1OC

BIRTHDAY: 2018-12-02T16:07:03.739122
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C13H15F3N8

SMILES: CNc1ncc(C(F)(F)F)c(Nc2n[nH]c(C(C)(C)C#N)c2N)n1

BIRTHDAY: 2018-12-02T16:07:03.758373
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C19H22F3N5O3

SMILES: CNc1c(Nc2cccc(C(=O)N3CCO[C@@H](C)C3)c2OC)ncnc1C(F)(F)F

BIRTHDAY: 2018-12-02T16:07:03.787643
ATC: D11A
- DERMATOLOGICALS
- OTHER DERMATOLOGICAL PREPARATIONS
- OTHER DERMATOLOGICAL PREPARATIONS
Synthesis Plan
FORMULA:C23H18N6OS

SMILES: N#Cc1ccccc1-c1ccncc1Nc1ccccc1[C@]12NC=C[C@H]1C(=O)NSN2

BIRTHDAY: 2018-12-02T16:07:03.798102
ATC: A07B
- ALIMENTARY TRACT AND METABOLISM
- ANTIDIARRHEALS, INTESTINAL ANTIINFLAMMATORY/ANTIINFECTIVE AGENTS
- INTESTINAL ADSORBENTS
Synthesis Plan
FORMULA:C31H37N3O2

SMILES: c1ccc(Oc2ccc(C3=NN(c4cc5ccc4CCCCNCCCCCCO5)CC3)cc2)cc1

BIRTHDAY: 2018-12-02T16:07:03.809329
ATC: A02B
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR ACID RELATED DISORDERS
- DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Synthesis Plan
FORMULA:C27H28N2O4

SMILES: C=C(C(=O)Nc1ccc(C(=O)Nc2cccc(C(C)C)c2)cc1)c1ccc(OC)cc1OC

BIRTHDAY: 2018-12-02T16:07:03.827920
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C21H18F3N7

SMILES: FC(F)(F)c1cncc(-c2cc3c(cn2)cnn3-c2cccc(N3CCNCC3)n2)c1

BIRTHDAY: 2018-12-02T16:07:03.848806
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H20F3N5O2S

SMILES: CNc1c(Nc2cc(OC)cc3c2OCC(C)(C)NS3)ncnc1C(F)(F)F

BIRTHDAY: 2018-12-03T10:43:25.748180
ATC: D10A
- DERMATOLOGICALS
- ANTI-ACNE PREPARATIONS
- ANTI-ACNE PREPARATIONS FOR TOPICAL USE
Synthesis Plan
FORMULA:C23H25N5

SMILES: Cc1cccc(-c2ccnn2C(C)(C)C)c1-c1nccc(C#N)c1NC1CC1

BIRTHDAY: 2018-12-03T10:43:25.757523
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C17H19F5N4O

SMILES: COc1cc(F)c(F)cc1Nc1ncnc(C(F)(F)F)c1N[C@H](C)C(C)C

BIRTHDAY: 2018-12-03T10:43:25.777070
ATC: L04A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- IMMUNOSUPPRESSANTS
- IMMUNOSUPPRESSANTS
Synthesis Plan
FORMULA:C23H16N4

SMILES: N#Cc1cccc(-c2cccnc2Nc2cccc(-c3cccnc3)c2)c1

BIRTHDAY: 2018-12-03T10:43:25.822452
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H20F3N7O2

SMILES: CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2-c2cn[nH]c2)ncc1C(F)(F)F

BIRTHDAY: 2018-12-03T10:43:25.834009
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C15H19N7O

SMILES: CC(C)N[C@]12C=CC=C(c3n[nH]cc3N)[C@]1(C(N)=O)C=CN=N2

BIRTHDAY: 2018-12-03T10:43:25.863204
ATC: V04C
- VARIOUS
- DIAGNOSTIC AGENTS
- OTHER DIAGNOSTIC AGENTS
Synthesis Plan
FORMULA:C18H19F3N4O

SMILES: CNc1cnc(C(F)(F)F)nc1Nc1cccc(OC)c1C1C2CC1C2

BIRTHDAY: 2018-12-03T10:43:25.882339
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C13H15F3N8

SMILES: CNc1ncc(Nc2n[nH]c(C(C)(C)C#N)c2N)c(C(F)(F)F)n1

BIRTHDAY: 2018-12-03T19:11:50.575001
ATC: L01C
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
Synthesis Plan
FORMULA:C20H29N7O

SMILES: CC(C)n1cnc2nc(NC(C)(C)C(C)(C)O)nc(NCc3ccccn3)c21

BIRTHDAY: 2018-12-03T19:11:50.592911
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C23H25N5

SMILES: Cc1cc(-c2cc(C#N)nc(NC3CC3)c2)cc(-c2cnn(C(C)(C)C)c2)c1

BIRTHDAY: 2018-12-03T19:11:50.601363
ATC: C02C
- CARDIOVASCULAR SYSTEM
- ANTIHYPERTENSIVES
- ANTIADRENERGIC AGENTS, PERIPHERALLY ACTING
Synthesis Plan
FORMULA:C16H23F3N6

SMILES: Cc1cc(Nc2ncnc(C(F)(F)F)c2NC(C)C)nn1C(C)(C)C

BIRTHDAY: 2018-12-03T19:11:50.622000
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C18H29N7S

SMILES: CSc1nc(-c2cnccc2N[C@H]2CC[C@](N)(CC(C)C)CN2)[nH]c1N

BIRTHDAY: 2018-12-03T19:11:50.651821
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C19H22N4O2

SMILES: COc1ccccc1-c1c(N[C@@H]2CCCCO2)cnc2cnn(C)c12

BIRTHDAY: 2018-12-03T19:11:50.660809
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C24H21F3N4O3

SMILES: Cc1cc(-n2nc(-c3ccc(C(F)(F)F)cc3)oc2=O)nn(-c2ccc(C(C)(C)C)cc2)c1=O

BIRTHDAY: 2018-12-03T19:11:50.690200
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:C16H21N5O

SMILES: COc1ccccc1[C@H]1N(C(C)(C)C)N=C2C=NC=N[C@@]21N

BIRTHDAY: 2018-12-03T19:11:50.737394
ATC: C05B
- CARDIOVASCULAR SYSTEM
- VASOPROTECTIVES
- ANTIVARICOSE THERAPY
Synthesis Plan
FORMULA:C27H28N6O3

SMILES: COc1ccccc1-c1c[nH]nc1C(=O)Nc1cccc2c1CN[C@H](N)CCc1cncc(c1)OC2

BIRTHDAY: 2018-12-01T22:30:56.555561
ATC: H01B
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
- POSTERIOR PITUITARY LOBE HORMONES
Synthesis Plan
FORMULA:C24H22N4O2

SMILES: Cc1cc(Nc2cccc(-c3ccc(C#N)cc3)n2)ccc1C(=O)N1CCOCC1

BIRTHDAY: 2018-12-01T22:30:56.564980
ATC: C01C
- CARDIOVASCULAR SYSTEM
- CARDIAC THERAPY
- CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
Synthesis Plan
FORMULA:C9H9ClFNO

SMILES: C[C@@H](NCl)C(=O)c1cccc(F)c1

BIRTHDAY: 2018-12-01T22:30:56.571386
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C21H22F3N7O2

SMILES: CNc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2-c2cnn(C)c2)ncc1C(F)(F)F

BIRTHDAY: 2018-12-01T22:30:56.591730
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H26N4S2

SMILES: CC(C)Nc1c(NC2CC2)ncnc1C1CSCCCSC1

BIRTHDAY: 2018-12-01T22:30:56.599811
ATC: S01E
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- ANTIGLAUCOMA PREPARATIONS AND MIOTICS
Synthesis Plan
FORMULA:C18H20F3N5O3

SMILES: CNc1ncc(Nc2cccc(C(=O)N3CCOCC3)c2OC)c(C(F)(F)F)n1

BIRTHDAY: 2018-12-01T22:30:56.647057
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C18H15F5N4

SMILES: CC(C)Nc1nc(Nc2ccc(F)cc2F)c2cc(C(F)(F)F)ccc2n1

BIRTHDAY: 2018-12-01T22:30:56.656740
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H21N5O

SMILES: COc1ccccc1[C@@]12C=NC=N[C@@]1(N)C=NN2C(C)(C)C

BIRTHDAY: 2018-12-01T22:30:56.675078
ATC: G02A
- GENITO URINARY SYSTEM AND SEX HORMONES
- OTHER GYNECOLOGICALS
- UTEROTONICS
Synthesis Plan