In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 17 | Yes |
Popular Name: (3S)-1-[(2-bromo-5-fluoro-phenyl)methyl]pyrrolidine-3-carboxamide (3S)-1-[(2-bromo-5-fluoro-phenyl…
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) | 1.88 | 4.89 | -37.13 | 3 | 3 | 1 | 48 | 302.167 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 2.51 | -7.62 | 2 | 3 | 0 | 46 | 301.159 | 3 | ↓ |