Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C16H15N7O2 |
| Molecular Weight | 337.336 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NC1=NC(NCCC2=CC=C(O)C=C2)=NC3=NC(=NN13)C4=CC=CO4
InChI
InChIKey=PWTBZOIUWZOPFT-UHFFFAOYSA-N
InChI=1S/C16H15N7O2/c17-14-20-15(18-8-7-10-3-5-11(24)6-4-10)21-16-19-13(22-23(14)16)12-2-1-9-25-12/h1-6,9,24H,7-8H2,(H3,17,18,19,20,21,22)
| Molecular Formula | C16H15N7O2 |
| Molecular Weight | 337.336 |
| 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/23602401 |
774.0 nM [Ki] | ||
Target ID: CHEMBL251 Sources: https://www.ncbi.nlm.nih.gov/pubmed/23602401 |
42.0 nM [IC50] | ||
Target ID: CHEMBL255 Sources: https://www.ncbi.nlm.nih.gov/pubmed/19743865 |
42.0 nM [Ki] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 19:18:57 GMT 2025
by
admin
on
Mon Mar 31 19:18:57 GMT 2025
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| Record UNII |
5NIC36BO71
|
| Record Status |
Validated (UNII)
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| Record Version |
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| Related Record | Type | Details | ||
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TARGET->WEAK INHIBITOR |
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TARGET -> INHIBITOR |
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OFF TARGET->WEAK INHIBITOR |
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TARGET -> INHIBITOR |
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ACTIVE MOIETY |
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