In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2009 | 37 | Yes |
Popular Name: (4-benzhydrylpiperazin-1-yl)-[6-methyl-2-(3-thienyl)-4-quinolyl]methanone (4-benzhydrylpiperazin-1-yl)-[6-…
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) | 6.11 | 15.46 | -11.83 | 0 | 4 | 0 | 36 | 503.671 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.11 | 17.05 | -48.63 | 1 | 4 | 1 | 38 | 504.679 | 5 | ↓ |