In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 19 | Yes |
Popular Name: 4-chloro-2-[(4-ethyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]benzoic 4-chloro-2-[(4-ethyl-5-oxo-1H-1,…
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) | 2.11 | 6.53 | -45.19 | 1 | 6 | -1 | 91 | 298.731 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.