| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 21 | Yes |
Popular Name: N-(2-amino-4-fluoro-phenyl)-4-[[(2R)-2-cyanopropyl]-methyl-amino]butanamide N-(2-amino-4-fluoro-phenyl)-4-[[…
| 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) | 1.79 | 6.22 | -54.22 | 4 | 5 | 1 | 83 | 293.366 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.79 | 4.17 | -16.15 | 3 | 5 | 0 | 82 | 292.358 | 7 | ↓ |
