| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 15th, 2011 | 22 | Yes |
Popular Name: 6-(aminomethyl)-N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-N,2-dimethyl-pyrimidin-4-amine 6-(aminomethyl)-N-[(6-fluoro-1H-…
| 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) | 1.10 | 4.89 | -51 | 4 | 6 | 1 | 85 | 301.349 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.10 | 4.87 | -31.72 | 4 | 6 | 1 | 85 | 301.349 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.10 | 4.48 | -13.27 | 3 | 6 | 0 | 84 | 300.341 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.10 | 5.5 | -81.59 | 5 | 6 | 2 | 86 | 302.357 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
