In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 18 | Yes |
Popular Name: (2S,4S)-4-hydroxy-N-(2,3,4-trifluorophenyl)pyrrolidine-2-carboxamide (2S,4S)-4-hydroxy-N-(2,3,4-trifl…
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) | 0.72 | 0.5 | -50.4 | 4 | 4 | 1 | 66 | 261.223 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.72 | -0.8 | -13.09 | 3 | 4 | 0 | 61 | 260.215 | 2 | ↓ |