matter.farm

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

These compounds may interact with:

Corticotropin-releasing factor receptor 1

Potentially involved in: osteoporosis; carcinoma; chronic kidney disease; post-traumatic stress disorder; irritable bowel syndrome; alcohol dependence; panic disorder; major depressive disorder; koolen de vries syndrome; generalized anxiety disorder; invasive aspergillosis; substance abuse; alcoholic intoxication, chronic; anorexia; anxiety disorders; bipolar disorder; mental depression; depressive disorder; contact dermatitis; psychotic disorders

Disease data sourced from Pharos.

Antagonist

FORMULA:C23H33N7

SMILES: CCC(CC)Nc1ncc2c(n1)CNc1cccc(c1)NC[C@@](C#N)(C(C)C)CN2

BIRTHDAY: 2018-12-01T14:10:51.561822
ATC: A03F
- ALIMENTARY TRACT AND METABOLISM
- DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
- PROPULSIVES
Synthesis Plan
FORMULA:C21H29N5

SMILES: CCC(CC)Nc1c(C)ncc2[nH]nc(Nc3cc(C)c(C)c(C)c3)c12

BIRTHDAY: 2018-12-01T14:10:51.569983
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C17H19Cl2N5

SMILES: CCC(CC)Nc1nc(C)nc2ncn(-c3cccc(Cl)c3Cl)c12

BIRTHDAY: 2018-12-01T14:10:51.578810
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C21H30O2S

SMILES: CC[C@]12C=C(C(C)(C)C)C(C)=C[C@@H]1Oc1cc(C(C)(C)C)sc1O2

BIRTHDAY: 2018-12-01T14:10:51.586018
ATC: B06A
- BLOOD AND BLOOD FORMING ORGANS
- OTHER HEMATOLOGICAL AGENTS
- OTHER HEMATOLOGICAL AGENTS
Synthesis Plan
FORMULA:C20H26Cl2N4

SMILES: CC1=CN2NC(c3cc(Cl)cc(Cl)c3)=C(C)[C@]2(N(C(C)C)C(C)C)N=C1

BIRTHDAY: 2018-12-01T14:10:51.594922
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C20H26Cl2N4

SMILES: CC1=CN2NC(c3cc(Cl)cc(Cl)c3)=C(C)[C@@]2(N(C(C)C)C(C)C)N=C1

BIRTHDAY: 2018-12-01T14:10:51.603867
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C18H30N4O2

SMILES: CCCN(CCC)c1nc(=O)n2c(c1C)OC(N(CC)CC)=CC2

BIRTHDAY: 2018-12-01T14:10:51.611668
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C27H35N3O2

SMILES: Cc1cccc(N(CCCN(Cc2cccnc2)c2c(C)cc(C)cc2C)CC(O)O)c1

BIRTHDAY: 2018-12-01T14:10:51.621217
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C20H24Cl2N4

SMILES: Cc1nc2c(-c3c(Cl)cccc3Cl)c(C)nn2cc1N(C(C)C)C(C)C

BIRTHDAY: 2018-12-01T14:10:51.629576
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C17H19Cl2N5

SMILES: CCC(CC)Nc1nc(C)nc2c1ncn2-c1c(Cl)cccc1Cl

BIRTHDAY: 2018-12-01T14:10:51.637970
ATC: M01A
- MUSCULO-SKELETAL SYSTEM
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
- ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
Synthesis Plan
FORMULA:C20H26Cl2N4

SMILES: CC1=N[C@@]2(N(C(C)C)C(C)C)C(C)=C(c3cc(Cl)cc(Cl)c3)NN2C=C1

BIRTHDAY: 2018-12-01T14:10:51.655328
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C17H19Cl2N5

SMILES: CCC(CC)Nc1nc(C)c2c(ncn2-c2cccc(Cl)c2Cl)n1

BIRTHDAY: 2018-12-01T14:10:51.663712
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C27H32N4O2

SMILES: Cc1ccc(C)c(N(C(C)(O)O)C(C)(C)N(Cc2cccnc2)c2ccccc2C#N)c1C

BIRTHDAY: 2018-12-25T02:02:54.453367
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C17H18Cl3N5

SMILES: CCC(CC)Nc1nc(C)c2c(ncn2-c2ccc(Cl)c(Cl)c2Cl)n1

BIRTHDAY: 2018-12-25T02:02:54.480325
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C21H29N5

SMILES: CCC(CC)Nc1cc(C)c2c(Nc3c(C)cc(C)cc3C)n[nH]c2n1

BIRTHDAY: 2018-12-25T02:02:54.488357
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H26N6

SMILES: CCC(CC)Nc1nc(C)nc2nnn(-c3cc(C)c(C)c(C)c3)c12

BIRTHDAY: 2018-12-25T02:02:54.523655
ATC: V06D
- VARIOUS
- GENERAL NUTRIENTS
- OTHER NUTRIENTS
Synthesis Plan
FORMULA:C31H40N4O2S

SMILES: CCC(CC)Nc1c2cccc1Sc1ncnc(c1[C@H](C)C(C)C)-c1cccc(c1)CNCCC(=O)CO2

BIRTHDAY: 2018-12-25T02:02:54.534838
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H29N7O2

SMILES: CCC(CC)Nc1nc(C)c2c(ncn2-c2cccc3c(=O)n(Cc4cccc(C)c4)c(=O)[nH]c23)n1

BIRTHDAY: 2018-12-25T02:02:54.562314
ATC: C09C
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ANGIOTENSIN II ANTAGONISTS, PLAIN
Synthesis Plan
FORMULA:C19H26N6

SMILES: CCC(CC)Nc1nc(C)c2c(nnn2-c2cc(C)cc(C)c2C)n1

BIRTHDAY: 2018-12-25T02:02:54.587172
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H26N6

SMILES: CCC(CC)Nc1nc(C)c2c(nnn2-c2cc(C)c(C)c(C)c2)n1

BIRTHDAY: 2018-12-25T02:02:54.595422
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C19H22Cl2N4

SMILES: CCC(CC)Nc1c(C)ncc2c1c(-c1cc(Cl)cc(Cl)c1)nn2C

BIRTHDAY: 2018-12-03T02:38:58.184432
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C5H10F3Sb

SMILES: CC[C@@H](C[SbH2])C(F)(F)F

BIRTHDAY: 2018-12-03T02:38:58.207086
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C17H19Cl2N5

SMILES: CCC(CC)Nc1nc(C)nc2cnn(-c3cccc(Cl)c3Cl)c12

BIRTHDAY: 2018-12-03T02:38:58.216171
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C17H18Cl3N5

SMILES: CCC(CC)Nc1nc(C)nc2ncn(-c3ccc(Cl)c(Cl)c3Cl)c12

BIRTHDAY: 2018-12-03T02:38:58.234625
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C30H33N7O2S

SMILES: CCC(CC)Nc1nc(C)c2c(n1)nc1cc3nc(n12)Nc1cccc(c1)COCC=CCOCc1cc-3cs1

BIRTHDAY: 2018-12-03T02:38:58.255905
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:C17H23N5S

SMILES: CCC(CC)Nc1nc(C)nc2ncn(-c3csc(C)c3C)c12

BIRTHDAY: 2018-12-03T02:38:58.273745
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C17H18Cl3N5

SMILES: CCC(CC)Nc1nc(C)nc2c1ncn2-c1c(Cl)cc(Cl)cc1Cl

BIRTHDAY: 2018-12-03T02:38:58.282703
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H26Cl2N4

SMILES: CC1=N[C@@]2(C)C=C(c3c(Cl)cccc3Cl)NN2C=C1N(C(C)C)C(C)C

BIRTHDAY: 2018-12-03T02:38:58.308941
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:C12H15N3O2

SMILES: Cc1cc(C)c(N[C@]2(C)N=[O+][N-]C2=O)c(C)c1

BIRTHDAY: 2018-11-30T03:40:55.502331
ATC: J01C
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- BETA-LACTAM ANTIBACTERIALS, PENICILLINS
Synthesis Plan
FORMULA:C27H29Cl3N4O

SMILES: COCCN(CCCN(Cc1ccc(C)c(C)n1)c1ccc(C#N)cc1)c1cc(Cl)c(Cl)cc1Cl

BIRTHDAY: 2018-11-30T03:40:55.512546
ATC: C09A
- CARDIOVASCULAR SYSTEM
- AGENTS ACTING ON THE RENIN-ANGIOTENSIN SYSTEM
- ACE INHIBITORS, PLAIN
Synthesis Plan
FORMULA:C20H31NO

SMILES: CCC(CC)N[C@H]1[C@@H]2C[C@H](Cc3cc(C)ccc3C)[C@@H]1CO2

BIRTHDAY: 2018-11-30T03:40:55.528591
ATC: J01F
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
Synthesis Plan
FORMULA:C27H35N3O2

SMILES: Cc1cccc(N(CCCN(Cc2ccccn2)c2c(C)cc(C)cc2C)CC(O)O)c1

BIRTHDAY: 2018-11-30T03:40:55.572380
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C23H32N4O

SMILES: CCC(CC)N[C@@]12N=C3CCOC3=CN1NC(c1cc(C)c(C)c(C)c1)=C2C

BIRTHDAY: 2018-11-30T03:40:55.580901
ATC: B02A
- BLOOD AND BLOOD FORMING ORGANS
- ANTIHEMORRHAGICS
- ANTIFIBRINOLYTICS
Synthesis Plan
FORMULA:C23H35N3O2

SMILES: Cc1cc(C)c(N(CCCN(Cc2ccccn2)C(C)C)CC(O)O)c(C)c1

BIRTHDAY: 2018-11-30T03:40:55.597863
ATC: C08E
- CARDIOVASCULAR SYSTEM
- CALCIUM CHANNEL BLOCKERS
- NON-SELECTIVE CALCIUM CHANNEL BLOCKERS
Synthesis Plan
FORMULA:C17H19Cl2N5

SMILES: CCC(CC)Nc1nc(C)nc2ncn(-c3cc(Cl)cc(Cl)c3)c12

BIRTHDAY: 2018-11-30T03:40:55.615697
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C20H24Cl2N4

SMILES: CCCN(CCC)c1cc(C)nc2c(-c3c(Cl)cccc3Cl)c(C)nn12

BIRTHDAY: 2018-11-30T03:40:55.624064
ATC: P02C
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTHELMINTICS
- ANTINEMATODAL AGENTS
Synthesis Plan
FORMULA:C20H22Cl2N4O

SMILES: CCC(CC)Nc1c2c(nc3c(-c4ccc(Cl)cc4Cl)c(C)nn13)OCC2

BIRTHDAY: 2018-11-30T03:40:55.633025
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C28H37N3O

SMILES: CO[C@@H](C)N(c1ccccc1C)C(C)(C)N(Cc1ccncc1)c1ccc(C)c(C)c1C

BIRTHDAY: 2018-11-30T03:40:55.642079
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C28H37N3O

SMILES: CO[C@H](C)N(c1ccccc1C)C(C)(C)N(Cc1ccncc1)c1c(C)ccc(C)c1C

BIRTHDAY: 2018-11-30T03:40:55.651400
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:C33H32Cl2FN3O2S

SMILES: CCCN(C[C@H]1CCSC(=O)N1c1ccc(Cl)c(Cl)c1)C(=O)c1ccc([C@]2(F)[C@@H]3[C@@H]4[C@H]5[C@@H]6N[C@@H]7[C@H]([C@@H]63)[C@@H]2[C@@]42C[C@@]752)cc1

BIRTHDAY: 2018-11-19T08:16:35.334645
ATC: N02C
- NERVOUS SYSTEM
- ANALGESICS
- ANTIMIGRAINE PREPARATIONS
Synthesis Plan
FORMULA:C23H27ClF3N3O

SMILES: CCC(CC)Nc1cc2c(cn1)[C@@H]1COC[C@H](C2)N1[C@@H](c1ccc(Cl)cc1)C(F)(F)F

BIRTHDAY: 2018-11-19T08:16:35.362609
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C21H28Cl2N4

SMILES: CC1=CN2NC(c3cc(Cl)cc(Cl)c3)=C(C)[C@@]2(N(C(C)C)C(C)C)N=C1C

BIRTHDAY: 2018-11-19T08:16:35.379999
ATC: S01L
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- OCULAR VASCULAR DISORDER AGENTS
Synthesis Plan
FORMULA:C20H26Cl2N4

SMILES: CC1=CN2NC(c3cc(Cl)ccc3Cl)=C(C)[C@@]2(N(C(C)C)C(C)C)N=C1

BIRTHDAY: 2018-11-19T08:16:35.389100
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C18H24N6O2S

SMILES: CCC(CC)Nc1nc(C)c2c(nnn2-c2cccc(C)c2S(C)(=O)=O)n1

BIRTHDAY: 2018-11-19T08:16:35.399123
ATC: V08A
- VARIOUS
- CONTRAST MEDIA
- X-RAY CONTRAST MEDIA, IODINATED
Synthesis Plan
FORMULA:C28H34N4O

SMILES: CO[C@@H](C)N(c1c(C)ccc(C)c1C)C(C)(C)N(Cc1cccnc1)c1ccccc1C#N

BIRTHDAY: 2018-11-19T08:16:35.440737
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C17H19Cl2N5

SMILES: CCC(CC)Nc1nc(C)c2c(ncn2-c2c(Cl)cccc2Cl)n1

BIRTHDAY: 2018-11-19T08:16:35.449306
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C20H26Cl2N4

SMILES: CC1=N[C@]2(N(C(C)C)C(C)C)C(C)=C(c3cc(Cl)cc(Cl)c3)NN2C=C1

BIRTHDAY: 2018-11-19T08:16:35.467455
ATC: M04A
- MUSCULO-SKELETAL SYSTEM
- ANTIGOUT PREPARATIONS
- ANTIGOUT PREPARATIONS
Synthesis Plan
FORMULA:C19H22Cl2N4

SMILES: CCC(CC)Nc1ncc(C)c2c1c(-c1ccc(Cl)cc1Cl)nn2C

BIRTHDAY: 2018-11-19T08:16:35.476142
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C19H25BrN6

SMILES: CCC(CC)Nc1nc(C)c2c(nnn2-c2cccc(Br)c2C(C)C)n1

BIRTHDAY: 2018-11-19T08:16:35.484871
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C17H19Cl2N5

SMILES: CCC(CC)Nc1nc(C)nc2c1ncn2-c1ccc(Cl)c(Cl)c1

BIRTHDAY: 2018-11-19T08:16:35.493382
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C24H26F6N2

SMILES: CC[C@@H](c1ccccc1)C12CCC(CC1)[C@@](N)(c1ccc(C(F)(F)F)c(C(F)(F)F)c1)N2

BIRTHDAY: 2018-11-19T08:16:35.503977
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C19H24Cl2N6O2

SMILES: COCCCN(CCOC)c1nc(C)nc2c1nnn2-c1c(Cl)cc(C)cc1Cl

BIRTHDAY: 2018-11-19T08:16:35.514002
ATC: J01X
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- OTHER ANTIBACTERIALS
Synthesis Plan
FORMULA:C17H16Cl2N2

SMILES: CC1=Nc2c(C)cc(C)cc2[C@H]1Nc1ccc(Cl)cc1Cl

BIRTHDAY: 2018-11-19T08:16:35.521525
ATC: D01A
- DERMATOLOGICALS
- ANTIFUNGALS FOR DERMATOLOGICAL USE
- ANTIFUNGALS FOR TOPICAL USE
Synthesis Plan
FORMULA:C28H37N3O

SMILES: CO[C@@H](C)N(c1ccccc1C)C(C)(C)N(Cc1ccccn1)c1c(C)ccc(C)c1C

BIRTHDAY: 2018-11-19T08:16:35.558147
ATC: V08C
- VARIOUS
- CONTRAST MEDIA
- MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
Synthesis Plan
FORMULA:C39H41ClN8O2

SMILES: CCCN(CCC)c1cc(C)nc2c(-c3cc4c(cc3Cl)COCc3cncc(c3)-c3ccnc(n3)Nc3cccc(c3)COC4)c(C)nn12

BIRTHDAY: 2018-11-19T08:16:35.572474
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C17H19Cl2N5

SMILES: CCC(CC)Nc1nc(C)nc2c1ncn2-c1ccc(Cl)cc1Cl

BIRTHDAY: 2018-11-19T08:16:35.589307
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H23Cl2N3O2

SMILES: CCN(CCCc1c(-c2ccc(Cl)cc2Cl)nc2ccccn12)CC(O)O

BIRTHDAY: 2018-11-19T08:16:35.598271
ATC: R05D
- RESPIRATORY SYSTEM
- COUGH AND COLD PREPARATIONS
- COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
Synthesis Plan
FORMULA:C24H35Cl2N5

SMILES: CC1=N[C@](NC(C)(C)C)(N(C(C)C)C(C)C)N2NC(c3cccc(Cl)c3Cl)=C(C)C2=C1

BIRTHDAY: 2018-11-19T08:16:35.609091
ATC: J01C
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIBACTERIALS FOR SYSTEMIC USE
- BETA-LACTAM ANTIBACTERIALS, PENICILLINS
Synthesis Plan
FORMULA:C21H36N4O5

SMILES: CC1=CC=N[C@]2(N(C(C)C)C(C)C)C3=C(NN12)OCCOCCOCCOCCO3

BIRTHDAY: 2018-11-19T08:16:35.620133
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C36H42ClN9O2

SMILES: CCC(CC)Nc1nc(C)nc2ncn(-c3ccc(Cl)c4c5cc(cc34)CNCCN[C@H]3CN(CC3=O)[C@@H](N)Cc3cccc(c3)O5)c12

BIRTHDAY: 2018-11-19T08:16:35.634522
ATC: R03D
- RESPIRATORY SYSTEM
- DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
- OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
Synthesis Plan
FORMULA:C15H23N5O3

SMILES: CCC(CC)Nc1nc(C)nc2c1ncn2[C@@H]1OOC(C)(C)O1

BIRTHDAY: 2018-11-19T08:16:35.643211
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C16H24N2O3

SMILES: CC[C@]1(c2c(OC)ccc(OC)c2OC)C[CH+][C@@H]([NH-])CN1

BIRTHDAY: 2018-11-19T08:16:35.651382
ATC: N07B
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- DRUGS USED IN ADDICTIVE DISORDERS
Synthesis Plan
FORMULA:C20H26Cl2N4

SMILES: CC1=CN2NC(c3cccc(Cl)c3Cl)=C(C)[C@]2(N(C(C)C)C(C)C)N=C1

BIRTHDAY: 2018-11-19T08:16:35.660473
ATC: G03B
- GENITO URINARY SYSTEM AND SEX HORMONES
- SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
- ANDROGENS
Synthesis Plan
FORMULA:C36H35N9O2S

SMILES: CCC(CC)Nc1nc(C)nc2c1nnn2-c1ccc2c(c1)C(=O)NCc1cccc(c1)-c1cc(ncn1)Sc1cccc(c1)OCC2

BIRTHDAY: 2018-11-19T08:16:35.674841
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C27H35N3O2

SMILES: Cc1ccccc1N(C(C)(O)O)C(C)(C)N(Cc1ccncc1)c1c(C)ccc(C)c1C

BIRTHDAY: 2018-11-19T08:16:35.685929
ATC: N01B
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, LOCAL
Synthesis Plan
FORMULA:C18H24N6O2S

SMILES: CCC(CC)Nc1nc(C)nc2c1nnn2-c1ccc(S(C)(=O)=O)cc1C

BIRTHDAY: 2018-11-19T08:16:35.695346
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C5H10S5

SMILES: CC[C@]1(C)CSSSSS1

BIRTHDAY: 2018-11-19T08:16:35.701554
ATC: C10A
- CARDIOVASCULAR SYSTEM
- LIPID MODIFYING AGENTS
- LIPID MODIFYING AGENTS, PLAIN
Synthesis Plan
FORMULA:C26H29Cl2FN4

SMILES: Fc1ccc(CN(Cc2cccc(Cl)c2Cl)c2ccnc(NCCCN3CCCC3)c2)cc1

BIRTHDAY: 2018-11-19T08:16:35.711543
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C27H35N3O2

SMILES: Cc1ccccc1N(C(C)(O)O)C(C)(C)N(Cc1ccncc1)c1ccc(C)c(C)c1C

BIRTHDAY: 2018-11-19T08:16:35.720843
ATC: S01F
- SENSORY ORGANS
- OPHTHALMOLOGICALS
- MYDRIATICS AND CYCLOPLEGICS
Synthesis Plan
FORMULA:C28H37N3O

SMILES: COCCN(CCCN(Cc1cccnc1)c1c(C)cc(C)cc1C)c1cccc(C)c1

BIRTHDAY: 2018-11-19T08:16:35.729993
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C22H21Cl2FN4

SMILES: Fc1cccc(CN(Cc2cc(Cl)cc(Cl)c2)c2cnc(CNC3CC3)cn2)c1

BIRTHDAY: 2018-11-19T08:16:35.739644
ATC: N05A
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- ANTIPSYCHOTICS
Synthesis Plan
FORMULA:C21H29N5

SMILES: CCC(CC)Nc1c(C)cnc2c(Nc3cc(C)c(C)c(C)c3)n[nH]c12

BIRTHDAY: 2018-11-30T17:23:17.194366
ATC: G01A
- GENITO URINARY SYSTEM AND SEX HORMONES
- GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
- ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
Synthesis Plan
FORMULA:C17H19Cl2N5

SMILES: CCC(CC)Nc1nc(C)nc2c1ncn2-c1cc(Cl)cc(Cl)c1

BIRTHDAY: 2018-11-30T17:23:17.210907
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H24Cl2N4

SMILES: CCCN(CCC)c1cc(C)nc2c(C)c(-c3ccc(Cl)cc3Cl)nn12

BIRTHDAY: 2018-11-30T17:23:17.219418
ATC: M03A
- MUSCULO-SKELETAL SYSTEM
- MUSCLE RELAXANTS
- MUSCLE RELAXANTS, PERIPHERALLY ACTING AGENTS
Synthesis Plan
FORMULA:C17H19Cl2N5

SMILES: CCC(CC)Nc1nc(C)c2c(ncn2-c2cc(Cl)cc(Cl)c2)n1

BIRTHDAY: 2018-11-30T17:23:17.253224
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C19H25BrN6

SMILES: CCC(CC)Nc1nc(C)nc2nnn(-c3cccc(Br)c3C(C)C)c12

BIRTHDAY: 2018-11-30T17:23:17.314087
ATC: V06D
- VARIOUS
- GENERAL NUTRIENTS
- OTHER NUTRIENTS
Synthesis Plan
FORMULA:C26H36N4O4

SMILES: CCC(CC)n1c(C(=O)N[C@H]2CC[C@H]3C=CC=C(OC)[C@@]3(OC)C2)cc(=O)c2c1c(C)nn2C

BIRTHDAY: 2018-11-30T17:23:17.324464
ATC: L01A
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- ALKYLATING AGENTS
Synthesis Plan
FORMULA:C27H35N3O2

SMILES: Cc1ccc(N(CCCN(Cc2ccccn2)c2c(C)cc(C)cc2C)CC(O)O)cc1

BIRTHDAY: 2018-11-30T17:23:17.333862
ATC: L01D
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
Synthesis Plan
FORMULA:C31H36N8O3

SMILES: CCC(CC)Nc1nc(C)nc2c1[C@](N)([C@@]13C=CC=C[C@H]1N=CN(C1CC1)C3=O)NCC=Cc1cncc(c1)OC2=O

BIRTHDAY: 2018-12-02T16:06:25.354910
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C27H32N4O2

SMILES: Cc1cc(C)c(N(C(C)(O)O)C(C)(C)N(Cc2ccncc2)c2ccccc2C#N)c(C)c1

BIRTHDAY: 2018-12-02T16:06:25.392151
ATC: N01A
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, GENERAL
Synthesis Plan
FORMULA:C25H41NO

SMILES: CCCN(CC1CCCCCCCCCC1)C(=O)c1c(C)cc(C)cc1C

BIRTHDAY: 2018-12-02T16:06:25.399651
ATC: V09C
- VARIOUS
- DIAGNOSTIC RADIOPHARMACEUTICALS
- RENAL SYSTEM
Synthesis Plan
FORMULA:C28H37N3O

SMILES: COCCN(CCCN(Cc1ccccn1)c1c(C)cc(C)cc1C)c1cccc(C)c1

BIRTHDAY: 2018-12-02T16:06:25.434837
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C19H29N3O2S

SMILES: Cc1ccc2c(c1N1C[C@@H](C)C(C)(C)CO1)N(CC(C)C)NC(=O)S2

BIRTHDAY: 2018-12-02T16:06:25.443545
ATC: J05A
- ANTIINFECTIVES FOR SYSTEMIC USE
- ANTIVIRALS FOR SYSTEMIC USE
- DIRECT ACTING ANTIVIRALS
Synthesis Plan
FORMULA:C19H25BrN6

SMILES: CCC(CC)Nc1nc(C)c2nnn(-c3ccc(C(C)C)cc3Br)c2n1

BIRTHDAY: 2018-12-02T16:06:25.452522
ATC: P01B
- ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
- ANTIPROTOZOALS
- ANTIMALARIALS
Synthesis Plan
FORMULA:C26H27Cl2FN4O

SMILES: C[C@H](NC(=O)c1cc(N(Cc2cccc(F)c2)Cc2cc(Cl)cc(Cl)c2)ccn1)N1CCCC1

BIRTHDAY: 2018-12-03T10:42:46.990809
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan
FORMULA:C14H24N6S

SMILES: CCC(CC)Nc1nc(C)c2c(nnn2SCC(C)C)n1

BIRTHDAY: 2018-12-03T10:42:47.025008
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C28H37N3O

SMILES: COCCN(CCCN(Cc1cccnc1)c1cc(C)c(C)cc1C)c1cccc(C)c1

BIRTHDAY: 2018-12-03T10:42:47.094494
ATC: H02C
- SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
- CORTICOSTEROIDS FOR SYSTEMIC USE
- ANTIADRENAL PREPARATIONS
Synthesis Plan
FORMULA:C28H34N4O

SMILES: COCCN(CCCN(Cc1ccccn1)c1ccc(C#N)cc1)c1c(C)cc(C)cc1C

BIRTHDAY: 2018-12-03T10:42:47.111963
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C27H29Cl3N4O

SMILES: CO[C@H](C)N(c1ccc(Cl)c(Cl)c1Cl)C(C)(C)N(Cc1ccnc(C)c1C)c1ccccc1C#N

BIRTHDAY: 2018-12-03T10:42:47.126418
ATC: C03D
- CARDIOVASCULAR SYSTEM
- DIURETICS
- POTASSIUM-SPARING AGENTS
Synthesis Plan
FORMULA:C27H40N8O4

SMILES: Cc1ncc2c3cc(cc2c1N(C(C)(O)O)C(C)(C)N1C=CNC(=O)O1)N[C@]1(C)NCC[C@@H]1CCNCCN3

BIRTHDAY: 2018-12-03T19:11:12.126116
ATC: L01X
- ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
- ANTINEOPLASTIC AGENTS
- OTHER ANTINEOPLASTIC AGENTS
Synthesis Plan
FORMULA:C20H24Cl2N4O

SMILES: CCC(CC)N[C@@]12N=C3CCOC3=CN1NC(c1cc(Cl)cc(Cl)c1)=C2C

BIRTHDAY: 2018-12-03T19:11:12.135244
ATC: D07A
- DERMATOLOGICALS
- CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
- CORTICOSTEROIDS, PLAIN
Synthesis Plan
FORMULA:C26H27N5O

SMILES: COCCN(CCCN(Cc1cccnc1)c1ccc(C#N)cc1)c1ccc(C#N)cc1

BIRTHDAY: 2018-12-03T19:11:12.178547
ATC: N05C
- NERVOUS SYSTEM
- PSYCHOLEPTICS
- HYPNOTICS AND SEDATIVES
Synthesis Plan
FORMULA:C11H13N3

SMILES: Cc1[nH+]c([CH-]c2ccccc2)nn1C

BIRTHDAY: 2018-12-03T19:11:12.184900
ATC: N07C
- NERVOUS SYSTEM
- OTHER NERVOUS SYSTEM DRUGS
- ANTIVERTIGO PREPARATIONS
Synthesis Plan
FORMULA:C20H26Cl2N4

SMILES: CC1=C(c2cc(Cl)cc(Cl)c2)NN2C=CC(N(C(C)C)C(C)C)=N[C@@]12C

BIRTHDAY: 2018-12-03T19:11:12.202746
ATC: N01B
- NERVOUS SYSTEM
- ANESTHETICS
- ANESTHETICS, LOCAL
Synthesis Plan
FORMULA:C25H33N3O4

SMILES: CO[C@@H](C)N(c1ccccc1C)C(C)(C)N(c1ccccc1C#N)[C@@]1(C)OOC(C)(C)O1

BIRTHDAY: 2018-12-01T22:30:17.214004
ATC: N03A
- NERVOUS SYSTEM
- ANTIEPILEPTICS
- ANTIEPILEPTICS
Synthesis Plan
FORMULA:C20H24Cl2N4

SMILES: Cc1cc(N(C(C)C)C(C)C)n2nc(C)c(-c3ccc(Cl)c(Cl)c3)c2n1

BIRTHDAY: 2018-12-01T22:30:17.239190
ATC: C03C
- CARDIOVASCULAR SYSTEM
- DIURETICS
- HIGH-CEILING DIURETICS
Synthesis Plan
FORMULA:C26H27Cl2FN4O

SMILES: C[C@H](NC(=O)c1cc(N(Cc2cccc(F)c2)Cc2cc(Cl)ccc2Cl)ccn1)N1CCCC1

BIRTHDAY: 2018-12-01T22:30:17.285309
ATC: R06A
- RESPIRATORY SYSTEM
- ANTIHISTAMINES FOR SYSTEMIC USE
- ANTIHISTAMINES FOR SYSTEMIC USE
Synthesis Plan