| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 15th, 2008 | 25 | No |
Popular Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-hydroxyquinazolin-6-yl)thiourea 1-(1,3-benzodioxol-5-ylmethyl)-3…
| 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) | 1.66 | 5.74 | -19.41 | 3 | 7 | 0 | 88 | 354.391 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 4.64 | -62.44 | 2 | 7 | -1 | 91 | 353.383 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
