| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 21st, 2006 | 24 | No |
Popular Name: 3-(2-bromophenyl)-2-cyano-N-[3-(trifluoromethyl)phenyl]-prop-2-enamide 3-(2-bromophenyl)-2-cyano-N-[3-(…
| 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) | 4.64 | 9.32 | -8.1 | 1 | 3 | 0 | 53 | 395.178 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.83 | 7.66 | -38 | 0 | 3 | -1 | 59 | 394.17 | 4 | ↓ |
