In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2009 | 32 | Yes |
Popular Name: [4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone [4-[(2,5-dimethoxyphenyl)methyl]…
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) | 3.42 | 8.87 | -15 | 0 | 6 | 0 | 55 | 449.576 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 11.2 | -49.73 | 1 | 6 | 1 | 56 | 450.584 | 7 | ↓ |