Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H8ClN5O |
| Molecular Weight | 285.689 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NC1=NC2=C(C=C(Cl)C=C2)C3=NC(=NN13)C4=CC=CO4
InChI
InChIKey=MSJODEOZODDVGW-UHFFFAOYSA-N
InChI=1S/C13H8ClN5O/c14-7-3-4-9-8(6-7)12-17-11(10-2-1-5-20-10)18-19(12)13(15)16-9/h1-6H,(H2,15,16)
| Molecular Formula | C13H8ClN5O |
| Molecular Weight | 285.689 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL226 Sources: https://www.ncbi.nlm.nih.gov/pubmed/11111832 |
3.5 nM [Ki] | ||
Target ID: CHEMBL251 Sources: https://www.ncbi.nlm.nih.gov/pubmed/11111832 |
4.2 nM [Ki] | ||
Target ID: CHEMBL256 Sources: https://www.ncbi.nlm.nih.gov/pubmed/11111832 |
51.0 nM [Ki] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 06:42:23 GMT 2025
by
admin
on
Wed Apr 02 06:42:23 GMT 2025
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| Record UNII |
Y5A5D5E2AQ
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| Record Status |
Validated (UNII)
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| Record Version |
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DTXSID80146617
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Y5A5D5E2AQ
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admin on Wed Apr 02 06:42:23 GMT 2025 , Edited by admin on Wed Apr 02 06:42:23 GMT 2025
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104615-18-1
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admin on Wed Apr 02 06:42:23 GMT 2025 , Edited by admin on Wed Apr 02 06:42:23 GMT 2025
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2690
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admin on Wed Apr 02 06:42:23 GMT 2025 , Edited by admin on Wed Apr 02 06:42:23 GMT 2025
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CGS-15943
Created by
admin on Wed Apr 02 06:42:23 GMT 2025 , Edited by admin on Wed Apr 02 06:42:23 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
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TARGET -> INHIBITOR | |||
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TARGET -> INHIBITOR |
| Related Record | Type | Details | ||
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ACTIVE MOIETY |