In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 21 | Yes |
Popular Name: (1S,2R)-2-cyclohexyl-N-[(1S)-1-(3-pyridyl)ethyl]cyclohexanamine (1S,2R)-2-cyclohexyl-N-[(1S)-1-(…
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) | 4.88 | 9.97 | -39.69 | 2 | 2 | 1 | 29 | 287.471 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.88 | 10.43 | -104.89 | 3 | 2 | 2 | 31 | 288.479 | 4 | ↓ |