| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 19 | Yes |
Popular Name: (2R)-2-amino-3-(1H-benzimidazol-2-ylsulfanyl)-2-cyclopropyl-propanoic (2R)-2-amino-3-(1H-benzimidazol-…
| 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) | -0.05 | 5.63 | -39.22 | 4 | 5 | 0 | 96 | 277.349 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | 5.44 | -50.51 | 3 | 5 | -1 | 95 | 276.341 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.05 | 6.02 | -60.75 | 5 | 5 | 1 | 98 | 278.357 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
