In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 33 | Yes |
Popular Name: (4-benzyl-1-piperidyl)-[6-[(3S)-3-phenylpiperazin-1-yl]-3-pyridyl]methanone (4-benzyl-1-piperidyl)-[6-[(3S)-…
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) | 3.92 | 13.83 | -50.3 | 2 | 5 | 1 | 53 | 441.599 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.92 | 12.74 | -9.58 | 1 | 5 | 0 | 48 | 440.591 | 5 | ↓ |