In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2010 | 23 | Yes |
Popular Name: [(3S,5R)-4-benzyl-3,5-dimethyl-piperazin-1-yl]-phenyl-methanone [(3S,5R)-4-benzyl-3,5-dimethyl-p…
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) | 2.85 | 7.93 | -9.68 | 0 | 3 | 0 | 24 | 308.425 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.85 | 10.03 | -42.89 | 1 | 3 | 1 | 25 | 309.433 | 3 | ↓ |