In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 18 | Yes |
Popular Name: (1S,2R)-1-[(3S,5S)-3,5-dimethyl-1-piperidyl]-1-phenyl-propan-2-amine (1S,2R)-1-[(3S,5S)-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) | 2.75 | 7.03 | -38.29 | 3 | 2 | 1 | 31 | 247.406 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.76 | 8 | -30.19 | 3 | 2 | 1 | 30 | 247.406 | 3 | ↓ |