| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2007 | 26 | Yes |
2-{[(4-methoxy-3-methylpyridin-2-yl)methyl]sulfinyl}-5-(1H-pyrrol-1-yl)-1H-benzimidazole
| 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) | 2.39 | 7 | -56.29 | 2 | 6 | 1 | 74 | 367.454 | 5 | ↓ |
| Ref Reference (pH 7) | 2.39 | 6.98 | -58.99 | 2 | 6 | 1 | 74 | 367.454 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 6.1 | -48.77 | 0 | 6 | -1 | 71 | 365.438 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 6.12 | -47.44 | 0 | 6 | -1 | 71 | 365.438 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 6.58 | -19.82 | 1 | 6 | 0 | 73 | 366.446 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 6.57 | -22.67 | 1 | 6 | 0 | 73 | 366.446 | 5 | ↓ |
