Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C14H15F3N6O |
| Molecular Weight | 340.3037 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NCCNC1=NC=C(C(N)=O)C(NC2=CC=CC(=C2)C(F)(F)F)=N1
InChI
InChIKey=FQNFLNSVHWCZML-UHFFFAOYSA-N
InChI=1S/C14H15F3N6O/c15-14(16,17)8-2-1-3-9(6-8)22-12-10(11(19)24)7-21-13(23-12)20-5-4-18/h1-3,6-7H,4-5,18H2,(H2,19,24)(H2,20,21,22,23)
| Molecular Formula | C14H15F3N6O |
| Molecular Weight | 340.3037 |
| 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: CHEMBL2599 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18938080 |
41.0 nM [IC50] | ||
Target ID: CHEMBL2803 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18077363 |
11200.0 nM [IC50] | ||
Target ID: CHEMBL5251 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18077363 |
15500.0 nM [IC50] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Apr 01 18:54:57 GMT 2025
by
admin
on
Tue Apr 01 18:54:57 GMT 2025
|
| Record UNII |
DHY3UC4XFH
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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9549296
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471901
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726695-51-8
Created by
admin on Tue Apr 01 18:54:57 GMT 2025 , Edited by admin on Tue Apr 01 18:54:57 GMT 2025
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DHY3UC4XFH
Created by
admin on Tue Apr 01 18:54:57 GMT 2025 , Edited by admin on Tue Apr 01 18:54:57 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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TARGET -> INHIBITOR |