In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2008 | 21 | Yes |
Popular Name: (5-chloro-2-fluoro-phenyl)-[(2S)-2-(4-pyridyl)pyrrolidin-1-yl]methanone (5-chloro-2-fluoro-phenyl)-[(2S)…
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) | 2.37 | 8.46 | -12.6 | 0 | 3 | 0 | 33 | 304.752 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.37 | 8.74 | -37.15 | 1 | 3 | 1 | 34 | 305.76 | 2 | ↓ |