| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 18 | Yes |
Popular Name: 5-[(4-Chlorophenyl)amino]-1H-1,2,3-triazole-4-carboxylic acid ethyl ester 5-[(4-Chlorophenyl)amino]-1H-1,2…
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CAS Number: 28924-63-2
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.03 | 5.35 | -5.57 | 2 | 6 | 0 | 80 | 266.688 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 5.34 | -35.19 | 1 | 6 | -1 | 78 | 265.68 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
