| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2005 | 33 | No |
Popular Name: (3-chloro-4-fluoro-phenyl)amino-(4-dimethylaminobut-2-enoyl)BLAHcarbonitrile (3-chloro-4-fluoro-phenyl)amino-…
| 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) | 4.46 | 2.19 | -51.17 | 2 | 7 | 1 | 82 | 466.924 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.46 | 2.28 | -94.02 | 3 | 7 | 2 | 83 | 467.932 | 5 | ↓ |
