| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 23 | Yes |
Popular Name: 1-[(3aS)-4,5-dimethyl-3aH-benzimidazol-2-yl]-N-[(3-isobutylimidazol-4-yl)methyl]methanamine 1-[(3aS)-4,5-dimethyl-3aH-benzim…
| 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) | 2.62 | 7.29 | -33.07 | 2 | 5 | 1 | 56 | 312.441 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.62 | 6.77 | -9.4 | 1 | 5 | 0 | 55 | 311.433 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
