| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 20 | Yes |
Popular Name: [(1R,2R,4R)-4-methyl-2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]cyclohexyl]methanamine [(1R,2R,4R)-4-methyl-2-[(5-methy…
| 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) | 3.35 | 6.99 | -52.43 | 4 | 3 | 1 | 56 | 290.456 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.35 | 7.03 | -90.44 | 5 | 3 | 2 | 58 | 291.464 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
