In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (1R,2S)-2-[(4-cyano-2-fluoro-phenyl)methyl-ethyl-carbamoyl]cyclopropanecarboxylic (1R,2S)-2-[(4-cyano-2-fluoro-phe…
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) | 1.63 | 9.04 | -57.33 | 0 | 5 | -1 | 84 | 289.286 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.63 | 7.08 | -19.79 | 1 | 5 | 0 | 81 | 290.294 | 5 | ↓ |