In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2009 | 32 | Yes |
Popular Name: (2S)-4-benzhydryl-2-[(3,4-dimethoxyphenyl)methyl]-1,2-dimethyl-piperazine (2S)-4-benzhydryl-2-[(3,4-dimeth…
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) | 5.29 | 13.8 | -44.41 | 1 | 4 | 1 | 26 | 431.6 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.29 | 12.06 | -7.2 | 0 | 4 | 0 | 25 | 430.592 | 7 | ↓ |