Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C16H15N5.2ClH.H2O |
| Molecular Weight | 368.261 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.Cl.NC(=N)C1=CC=C(C=C1)C2=CC3=CC=C(C=C3N2)C(N)=N
InChI
InChIKey=UJLVGXGUAMGVEX-UHFFFAOYSA-N
InChI=1S/C16H15N5.2ClH.H2O/c17-15(18)10-3-1-9(2-4-10)13-7-11-5-6-12(16(19)20)8-14(11)21-13;;;/h1-8,21H,(H3,17,18)(H3,19,20);2*1H;1H2
| Molecular Formula | C16H15N5 |
| Molecular Weight | 277.3238 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| 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: GO:0016049 Sources: https://pubmed.ncbi.nlm.nih.gov/18841956 |
0.86 µM [IC50] | ||
Target ID: Taxonomy ID: 31286 Sources: https://pubmed.ncbi.nlm.nih.gov/18841956 |
0.017 µM [IC50] | ||
Target ID: Taxonomy ID: 5839 Sources: https://pubmed.ncbi.nlm.nih.gov/18841956 |
0.003 µM [IC50] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:47:45 GMT 2025
by
admin
on
Mon Mar 31 22:47:45 GMT 2025
|
| Record UNII |
GK1ZZ31YQR
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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Common Name | English | ||
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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18676829
Created by
admin on Mon Mar 31 22:47:45 GMT 2025 , Edited by admin on Mon Mar 31 22:47:45 GMT 2025
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PRIMARY | |||
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GK1ZZ31YQR
Created by
admin on Mon Mar 31 22:47:45 GMT 2025 , Edited by admin on Mon Mar 31 22:47:45 GMT 2025
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PRIMARY |