In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 28 | Yes |
Popular Name: (4-methylpiperazin-1-yl)-[5-(4-phenoxyphenyl)-3-pyridyl]methanone (4-methylpiperazin-1-yl)-[5-(4-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) | 3.26 | 8.47 | -10.83 | 0 | 5 | 0 | 46 | 373.456 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.26 | 10.82 | -51.26 | 1 | 5 | 1 | 47 | 374.464 | 4 | ↓ |