| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 21 | Yes |
Popular Name: (2S)-2-(cyclopropylamino)-4-(5,6-dimethylbenzimidazol-1-yl)butanoic (2S)-2-(cyclopropylamino)-4-(5,6…
| 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) | 0.50 | 10.17 | -45.69 | 2 | 5 | 0 | 75 | 287.363 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.50 | 9.2 | -47.19 | 1 | 5 | -1 | 70 | 286.355 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.50 | 10.65 | -79.49 | 3 | 5 | 1 | 76 | 288.371 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
