Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C31H33ClN2O3 |
Molecular Weight | 517.058 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)[C@@H](N(CCCN)C(=O)C1=CC=C(C)C=C1)C2=C(CC3=CC=CC=C3)C(=O)C4=CC=C(Cl)C=C4O2
InChI
InChIKey=PGXYIBJJCLWJST-MUUNZHRXSA-N
InChI=1S/C31H33ClN2O3/c1-20(2)28(34(17-7-16-33)31(36)23-12-10-21(3)11-13-23)30-26(18-22-8-5-4-6-9-22)29(35)25-15-14-24(32)19-27(25)37-30/h4-6,8-15,19-20,28H,7,16-18,33H2,1-3H3/t28-/m1/s1
Molecular Formula | C31H33ClN2O3 |
Molecular Weight | 517.058 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: P52732 Gene ID: 3832.0 Gene Symbol: KIF11 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/25860245 |
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:01:56 GMT 2023
by
admin
on
Fri Dec 15 16:01:56 GMT 2023
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Record UNII |
24DSZ1VN92
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Record Status |
Validated (UNII)
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Record Version |
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-
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NCI_THESAURUS |
C67440
Created by
admin on Fri Dec 15 16:01:56 GMT 2023 , Edited by admin on Fri Dec 15 16:01:56 GMT 2023
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Code System | Code | Type | Description | ||
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618430-39-0
Created by
admin on Fri Dec 15 16:01:56 GMT 2023 , Edited by admin on Fri Dec 15 16:01:56 GMT 2023
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24DSZ1VN92
Created by
admin on Fri Dec 15 16:01:56 GMT 2023 , Edited by admin on Fri Dec 15 16:01:56 GMT 2023
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C52199
Created by
admin on Fri Dec 15 16:01:56 GMT 2023 , Edited by admin on Fri Dec 15 16:01:56 GMT 2023
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DTXSID801025653
Created by
admin on Fri Dec 15 16:01:56 GMT 2023 , Edited by admin on Fri Dec 15 16:01:56 GMT 2023
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9936388
Created by
admin on Fri Dec 15 16:01:56 GMT 2023 , Edited by admin on Fri Dec 15 16:01:56 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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TARGET -> INHIBITOR |
IC50
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SALT/SOLVATE -> PARENT |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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