In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 33 | No |
Popular Name: (2S)-N-benzhydryl-1-[2-(2,4-difluoroanilino)-2-oxo-ethyl]pyrrolidine-2-carboxamide (2S)-N-benzhydryl-1-[2-(2,4-difl…
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) | 4.44 | 12.43 | -44.67 | 3 | 5 | 1 | 63 | 450.509 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.63 | 10.32 | -33.26 | 2 | 5 | 0 | 69 | 449.501 | 7 | ↓ |