In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 13th, 2008 | 24 | Yes |
Popular Name: 3-[[2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic 3-[[2-[(4-butyl-5-oxo-1H-1,2,4-t…
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) | 2.15 | 6.02 | -65.48 | 2 | 8 | -1 | 120 | 349.392 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.