| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 21 | Yes |
Popular Name: N-[[5-[(5,6-dimethylbenzimidazol-1-yl)methyl]isoxazol-3-yl]methyl]ethanamine N-[[5-[(5,6-dimethylbenzimidazol…
| 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) | 2.79 | 8.83 | -52.45 | 2 | 5 | 1 | 60 | 285.371 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.79 | 7.45 | -13.39 | 1 | 5 | 0 | 56 | 284.363 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 9.3 | -98.35 | 3 | 5 | 2 | 62 | 286.379 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
