In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 33 | No |
Popular Name: (2S)-N-benzhydryl-1-[2-(4-chloro-2-fluoro-anilino)-2-oxo-ethyl]pyrrolidine-2-carboxamide (2S)-N-benzhydryl-1-[2-(4-chloro…
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) | 4.96 | 12.88 | -44.22 | 3 | 5 | 1 | 63 | 466.964 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.14 | 10.77 | -32.89 | 2 | 5 | 0 | 69 | 465.956 | 7 | ↓ |