In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2010 | 27 | Yes |
Popular Name: 1-[(3R,5R)-4-benzyl-3,5-dimethyl-piperazin-1-yl]-4-phenoxy-butan-1-one 1-[(3R,5R)-4-benzyl-3,5-dimethyl…
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) | 3.84 | 10.32 | -11.07 | 0 | 4 | 0 | 33 | 366.505 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.84 | 12.26 | -44.81 | 1 | 4 | 1 | 34 | 367.513 | 7 | ↓ |