In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 29 | Yes |
Popular Name: {3-[(4-benzylpiperazino)methyl]phenyl}(4-hydroxypiperidino)methanone {3-[(4-benzylpiperazino)methyl]p…
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) | 1.00 | 7.96 | -46.17 | 2 | 5 | 1 | 48 | 394.539 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.00 | 7.9 | -44.81 | 2 | 5 | 1 | 48 | 394.539 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.00 | 5.58 | -12.36 | 1 | 5 | 0 | 47 | 393.531 | 5 | ↓ |