In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 18 | Yes |
Popular Name: (1R,2S)-2-[(3S,5R)-3,5-dimethyl-1-piperidyl]-1-phenyl-propan-1-amine (1R,2S)-2-[(3S,5R)-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) | 1.41 | 7.56 | -28.52 | 3 | 2 | 1 | 30 | 247.406 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 7.81 | -114.49 | 4 | 2 | 2 | 32 | 248.414 | 3 | ↓ |