In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 10th, 2009 | 27 | Yes |
Popular Name: 1-methyl-1-[(4-oxo-3H-quinazolin-2-yl)methyl]-3-[3-(trifluoromethyl)phenyl]urea 1-methyl-1-[(4-oxo-3H-quinazolin…
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) | 3.11 | 8.1 | -18.28 | 2 | 6 | 0 | 78 | 376.338 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.57 | 7.05 | -50.42 | 1 | 6 | -1 | 81 | 375.33 | 4 | ↓ |