| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 16th, 2006 | 23 | Yes |
Popular Name: 1-(2,4-dihydroxyphenyl)-2-(4-hydroxyquinazolin-2-yl)sulfanyl-ethanone 1-(2,4-dihydroxyphenyl)-2-(4-hyd…
| 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) | 3.05 | 3.38 | -15.32 | 3 | 6 | 0 | 103 | 328.349 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 2.45 | -106.17 | 1 | 6 | -2 | 109 | 326.333 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 2.21 | -96.64 | 1 | 6 | -2 | 109 | 326.333 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.50 | 1.44 | -49.6 | 2 | 6 | -1 | 106 | 327.341 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.04 | 2.83 | -18.86 | 3 | 6 | 0 | 103 | 328.349 | 4 | ↓ |
