In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 30 | Yes |
Popular Name: (4-benzyl-1-piperidyl)-[6-[2-(1-piperidyl)ethylsulfanyl]-3-pyridyl]methanone (4-benzyl-1-piperidyl)-[6-[2-(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) | 4.12 | 14.14 | -43.4 | 1 | 4 | 1 | 38 | 424.634 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.12 | 11.86 | -7.76 | 0 | 4 | 0 | 36 | 423.626 | 7 | ↓ |