| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 28 | No |
Popular Name: 3-allyl-4-oxo-2-thioxo-N-[4-(trifluoromethyl)phenyl]-1H-quinazoline-7-carboxamide 3-allyl-4-oxo-2-thioxo-N-[4-(tri…
| 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) | 4.17 | 9.33 | -44.57 | 1 | 5 | -1 | 64 | 404.393 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.45 | 9.74 | -17.29 | 2 | 5 | 0 | 67 | 405.401 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
