| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 17 | No |
Popular Name: 2-[(3-chloro-4-fluoro-phenyl)methylamino]-N-(cyanomethyl)acetamide 2-[(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) | 1.66 | 2.74 | -12.39 | 2 | 4 | 0 | 65 | 255.68 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.66 | 4.09 | -61.15 | 3 | 4 | 1 | 69 | 256.688 | 5 | ↓ |
