In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 28th, 2008 | 22 | No |
Popular Name: (E)-2-cyano-N-(3,5-dichlorophenyl)-3-(2-fluorophenyl)prop-2-enamide (E)-2-cyano-N-(3,5-dichloropheny…
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) | 4.41 | 8.87 | -5.86 | 1 | 3 | 0 | 53 | 335.165 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.59 | 7.19 | -37.33 | 0 | 3 | -1 | 59 | 334.157 | 3 | ↓ |