In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: (1S,2R,4R)-2-(dipropylamino)-4-phenyl-cyclohexanecarbonitrile (1S,2R,4R)-2-(dipropylamino)-4-p…
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) | 4.98 | 11.79 | -42.75 | 1 | 2 | 1 | 28 | 285.455 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.98 | 9.86 | -7.98 | 0 | 2 | 0 | 27 | 284.447 | 6 | ↓ |