In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 27 | Yes |
Popular Name: N-(4-fluorophenyl)-2-[(2R)-2-(4-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide N-(4-fluorophenyl)-2-[(2R)-2-(4-…
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) | 2.84 | 11.02 | -36.1 | 2 | 5 | 1 | 59 | 363.416 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 10.56 | -10.91 | 1 | 5 | 0 | 58 | 362.408 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.84 | 11.42 | -97.88 | 3 | 5 | 2 | 61 | 364.424 | 4 | ↓ |