| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 4th, 2011 | 21 | Yes |
Popular Name: N-[(2-bromo-5-fluoro-phenyl)methyl]-1-(1-methylbenzimidazol-2-yl)methanamine N-[(2-bromo-5-fluoro-phenyl)meth…
| 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) | 3.46 | 7.83 | -10.66 | 1 | 3 | 0 | 30 | 348.219 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.46 | 8.26 | -28.95 | 2 | 3 | 1 | 31 | 349.227 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.46 | 9.24 | -48.35 | 2 | 3 | 1 | 34 | 349.227 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
