In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 29 | Yes |
Popular Name: 2-[4-(4-bromophenyl)-4-hydroxy-1-piperidyl]-1-(4-phenylpiperazin-1-yl)ethanone 2-[4-(4-bromophenyl)-4-hydroxy-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) | 3.52 | 10.13 | -48.08 | 2 | 5 | 1 | 48 | 459.408 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.52 | 7.96 | -10.8 | 1 | 5 | 0 | 47 | 458.4 | 4 | ↓ |