In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2010 | 24 | Yes |
Popular Name: [4-[(4-methoxy-3-methyl-phenyl)methyl]piperazin-1-yl]-(3-pyridyl)methanone [4-[(4-methoxy-3-methyl-phenyl)m…
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) | 1.39 | 5.91 | -11.85 | 0 | 5 | 0 | 46 | 325.412 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 8.02 | -49.21 | 1 | 5 | 1 | 47 | 326.42 | 4 | ↓ |