In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 27 | Yes |
Popular Name: 2-[(2-diethylaminoethylamino)methyl]-3-(4-fluorophenyl)quinazolin-4-one 2-[(2-diethylaminoethylamino)met…
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) | 2.94 | 10.34 | -41.72 | 2 | 5 | 1 | 51 | 369.464 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 9.51 | -48.72 | 2 | 5 | 1 | 55 | 369.464 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 8.16 | -8.51 | 1 | 5 | 0 | 50 | 368.456 | 8 | ↓ |