| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 16 | Yes |
Popular Name: 5-[(3-chloro-4-fluoro-phenyl)methylamino]pentanenitrile 5-[(3-chloro-4-fluoro-phenyl)met…
| 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) | 2.50 | 7.87 | -59.73 | 2 | 2 | 1 | 40 | 241.717 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.50 | 6.51 | -9.51 | 1 | 2 | 0 | 36 | 240.709 | 6 | ↓ |
