| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 21 | Yes |
Popular Name: (2S)-2-(cyclopropylamino)-4-(5,6-dimethylbenzimidazol-1-yl)butanamide (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) | 2.00 | 6.25 | -53.42 | 4 | 5 | 1 | 78 | 287.387 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 5.33 | -13.1 | 3 | 5 | 0 | 73 | 286.379 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 6.72 | -107.05 | 5 | 5 | 2 | 79 | 288.395 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
