In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2010 | 20 | Yes |
Popular Name: N-(4-oxo-3H-quinazolin-6-yl)-2-(1,2,4-triazol-1-yl)acetamide N-(4-oxo-3H-quinazolin-6-yl)-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) | -0.71 | 5.02 | -24.09 | 2 | 8 | 0 | 106 | 270.252 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.26 | 2.98 | -70.67 | 1 | 8 | -1 | 109 | 269.244 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.