In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 34 | Yes |
Popular Name: (4-benzylpiperazin-1-yl)-[2-(3-methoxyphenyl)-6-methyl-4-quinolyl]methanone (4-benzylpiperazin-1-yl)-[2-(3-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) | 4.78 | 11.6 | -12.93 | 0 | 5 | 0 | 46 | 451.57 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.78 | 13.81 | -53.71 | 1 | 5 | 1 | 47 | 452.578 | 5 | ↓ |