In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2005 | 23 | No |
Popular Name: 3-(4-ethylphenyl)-2-(4-oxo-3H-quinazolin-2-yl)-prop-2-enenitrile 3-(4-ethylphenyl)-2-(4-oxo-3H-qu…
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) | 4.31 | 8.48 | -41.81 | 0 | 4 | -1 | 73 | 300.341 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.31 | 0.12 | -16.26 | 1 | 4 | 0 | 69 | 301.349 | 3 | ↓ |