In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 22nd, 2010 | 21 | Yes |
Popular Name: (2S)-2-cyano-3-phenyl-N-[2-(2-pyridyl)ethyl]propanamide (2S)-2-cyano-3-phenyl-N-[2-(2-py…
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) | 2.01 | 7.22 | -12.94 | 1 | 4 | 0 | 66 | 279.343 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 7.57 | -40.99 | 2 | 4 | 1 | 67 | 280.351 | 6 | ↓ |