In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 24 | Yes |
Popular Name: 1,3-dimethyl-N-(4-oxo-3H-quinazolin-6-yl)thieno[2,3-c]pyrazole-5-carboxamide 1,3-dimethyl-N-(4-oxo-3H-quinazo…
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) | 1.83 | 5.2 | -16.03 | 2 | 7 | 0 | 93 | 339.38 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 3.17 | -46.6 | 1 | 7 | -1 | 96 | 338.372 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.