In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 17 | Yes |
Popular Name: (1R,2R,3R)-2,3-dimethyl-N-[(1S)-1-(3-pyridyl)ethyl]cyclohexan-1-amine (1R,2R,3R)-2,3-dimethyl-N-[(1S)-…
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) | 3.21 | 7.4 | -38.52 | 2 | 2 | 1 | 29 | 233.379 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.21 | 7.85 | -102.79 | 3 | 2 | 2 | 31 | 234.387 | 3 | ↓ |