| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 21 | Yes |
Popular Name: (2S)-N-(2-aminophenyl)-2-[2-cyanoethyl(isobutyl)amino]propanamide (2S)-N-(2-aminophenyl)-2-[2-cyan…
| 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) | 1.49 | 6.47 | -51.62 | 4 | 5 | 1 | 83 | 289.403 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.49 | 5.02 | -11.49 | 3 | 5 | 0 | 82 | 288.395 | 7 | ↓ |
