In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 21 | Yes |
Popular Name: (2R)-2-cyano-3-phenyl-N-[(1R)-1-(4-pyridyl)ethyl]propanamide (2R)-2-cyano-3-phenyl-N-[(1R)-1-…
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) | 2.05 | 7.29 | -11.13 | 1 | 4 | 0 | 66 | 279.343 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.05 | 7.75 | -42.05 | 2 | 4 | 1 | 67 | 280.351 | 5 | ↓ |