In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2009 | 24 | Yes |
Popular Name: (2R,5S)-1-allyl-4-benzhydryl-2,5-dimethyl-piperazine (2R,5S)-1-allyl-4-benzhydryl-2,5…
None
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) | 4.72 | 11.73 | -32.15 | 1 | 2 | 1 | 8 | 321.488 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.72 | 11.25 | -29.02 | 1 | 2 | 1 | 8 | 321.488 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.72 | 9.5 | -2.05 | 0 | 2 | 0 | 6 | 320.48 | 5 | ↓ |