In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2008 | 28 | Yes |
Popular Name: 1-(4-benzylpiperazin-1-yl)-2-[(5-bromo-2-methoxy-phenyl)methyl-methyl-amino]ethanone 1-(4-benzylpiperazin-1-yl)-2-[(5…
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) | 3.18 | 10.11 | -42.6 | 1 | 5 | 1 | 37 | 447.397 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.18 | 7.97 | -9.93 | 0 | 5 | 0 | 36 | 446.389 | 7 | ↓ |