| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2011 | 21 | Yes |
Popular Name: (2S)-2-(cyclopropylamino)-4-(2-ethylbenzimidazol-1-yl)butanoic (2S)-2-(cyclopropylamino)-4-(2-e…
| 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) | 0.36 | 9.28 | -43.7 | 2 | 5 | 0 | 75 | 287.363 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.36 | 8.35 | -46.73 | 1 | 5 | -1 | 70 | 286.355 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | 9.64 | -67.54 | 3 | 5 | 1 | 76 | 288.371 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
