In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 23 | Yes |
Popular Name: 2-[(R)-(4-cyanophenyl)-(3-pyridyl)methyl]benzonitrile 2-[(R)-(4-cyanophenyl)-(3-pyridy…
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) | 3.32 | 10.53 | -9.85 | 0 | 3 | 0 | 60 | 295.345 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 11.09 | -44.12 | 1 | 3 | 1 | 62 | 296.353 | 3 | ↓ |