In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 40 | Yes |
Popular Name: 4-[[4-(4-benzhydrylpiperazine-1-carbonyl)phenyl]methyl]-7-methyl-1,4-benzoxazin-3-one 4-[[4-(4-benzhydrylpiperazine-1-…
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) | 5.09 | 15.46 | -12.87 | 0 | 6 | 0 | 53 | 531.656 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.09 | 17.04 | -47.12 | 1 | 6 | 1 | 54 | 532.664 | 6 | ↓ |