In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2006 | 23 | No |
Popular Name: N-(3-chloro-4-fluoro-phenyl)-2-cyano-3-(2,4-difluorophenyl)-prop-2-enamide N-(3-chloro-4-fluoro-phenyl)-2-c…
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) | 4.04 | 8.48 | -6 | 1 | 3 | 0 | 53 | 336.7 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.22 | 6.8 | -33.48 | 0 | 3 | -1 | 59 | 335.692 | 3 | ↓ |