In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2005 | 23 | No |
Popular Name: 3-(4-methoxyphenyl)-2-(4-oxo-3H-quinazolin-2-yl)-prop-2-enenitrile 3-(4-methoxyphenyl)-2-(4-oxo-3H-…
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) | 3.45 | 6.39 | -42.01 | 0 | 5 | -1 | 82 | 302.313 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.45 | -0.3 | -16.97 | 1 | 5 | 0 | 79 | 303.321 | 3 | ↓ |