In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 17 | Yes |
Popular Name: (1R,2S)-2-[(3S)-3-methyl-1-piperidyl]-1-phenyl-propan-1-amine (1R,2S)-2-[(3S)-3-methyl-1-piper…
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) | 0.94 | 6.95 | -28.41 | 3 | 2 | 1 | 30 | 233.379 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.94 | 7.22 | -113.25 | 4 | 2 | 2 | 32 | 234.387 | 3 | ↓ |