| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 4th, 2010 | 33 | No |
Popular Name: N-(1,3-benzodioxol-5-yl)-6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-amine N-(1,3-benzodioxol-5-yl)-6-[4-(2…
| 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) | 4.74 | 13.65 | -8.35 | 1 | 10 | 0 | 109 | 448.483 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.74 | 13.53 | -37.02 | 2 | 10 | 1 | 110 | 449.491 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.