In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 31 | Yes |
Popular Name: 4-[(4-benzylpiperazin-1-yl)methyl]-N-[2-(1-piperidyl)ethyl]benzamide 4-[(4-benzylpiperazin-1-yl)methy…
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) | 3.16 | 11.7 | -90.62 | 3 | 5 | 2 | 41 | 422.617 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 11.7 | -93.12 | 3 | 5 | 2 | 41 | 422.617 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 9.44 | -43.93 | 2 | 5 | 1 | 40 | 421.609 | 8 | ↓ |