In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 36 | Yes |
Popular Name: 1-(4-benzyl-1-piperidyl)-4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]butan-1-one 1-(4-benzyl-1-piperidyl)-4-[(4,5…
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) | 6.24 | 18.7 | -16.9 | 0 | 5 | 0 | 51 | 496.68 | 9 | ↓ |