In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 29 | Yes |
Popular Name: (2,4-difluorophenyl)-[4-[(2R)-2-(4-pyridyl)pyrrolidine-1-carbonyl]-1-piperidyl]methanone (2,4-difluorophenyl)-[4-[(2R)-2-…
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) | 1.98 | 9.93 | -23.98 | 0 | 5 | 0 | 54 | 399.441 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.98 | 10.36 | -47.99 | 1 | 5 | 1 | 55 | 400.449 | 3 | ↓ |