In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 20 | Yes |
Popular Name: 3-[[[(1S,2R)-2-tert-butylcyclohexyl]amino]methyl]benzonitrile 3-[[[(1S,2R)-2-tert-butylcyclohe…
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) | 4.70 | 10.57 | -45.48 | 2 | 2 | 1 | 40 | 271.428 | 4 | ↓ |