| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 32 | Yes |
Popular Name: 4-[benzofuran-5-ylmethyl(methyl)amino]-6-(2-morpholinoanilino)-1,3,5-triazin-2-ol 4-[benzofuran-5-ylmethyl(methyl)…
| 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) | 3.82 | 13.64 | -45.42 | 3 | 9 | 1 | 101 | 433.492 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.09 | 11.65 | -61.05 | 1 | 9 | -1 | 103 | 431.476 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 12.84 | -43.47 | 3 | 9 | 1 | 101 | 433.492 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
