In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 15th, 2008 | 30 | Yes |
Popular Name: (2S)-1-(4-benzylpiperazin-1-yl)-2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one (2S)-1-(4-benzylpiperazin-1-yl)-…
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) | 3.27 | 12.53 | -10.71 | 0 | 6 | 0 | 54 | 421.57 | 6 | ↓ |