| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 20 | Yes |
Popular Name: 3-[(1R)-1-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]ethyl]aniline 3-[(1R)-1-[(5-methyl-1H-benzimid…
| 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) | 3.78 | 7.6 | -7.28 | 3 | 3 | 0 | 55 | 283.4 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.78 | 7.65 | -25.67 | 4 | 3 | 1 | 56 | 284.408 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
