| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2005 | 33 | Yes |
Popular Name: (3-chloro-4-fluoro-phenyl)amino-(4-dimethylaminobutanoyl)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) | 3.82 | 1.99 | -48.97 | 2 | 7 | 1 | 82 | 468.94 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.82 | 2.08 | -91.61 | 3 | 7 | 2 | 83 | 469.948 | 6 | ↓ |
