In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 13 | Yes |
Popular Name: (3S)-3-[[(1R,2R)-2-methylcyclohexyl]amino]butanenitrile (3S)-3-[[(1R,2R)-2-methylcyclohe…
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) | 2.03 | 5.9 | -42.84 | 2 | 2 | 1 | 40 | 181.303 | 3 | ↓ |