In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 29 | Yes |
Popular Name: N-[(1S)-1-(4-fluorophenyl)ethyl]-6-[(2R)-2-(4-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide N-[(1S)-1-(4-fluorophenyl)ethyl]…
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) | 3.16 | 11.02 | -41.75 | 2 | 5 | 1 | 59 | 391.47 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 10.57 | -12.11 | 1 | 5 | 0 | 58 | 390.462 | 5 | ↓ |