In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2008 | 33 | Yes |
Popular Name: 4-[(6-chloro-4-morpholino-quinazolin-2-yl)methyl]-1-[(3-fluorophenyl)methyl]piperazin-2-one 4-[(6-chloro-4-morpholino-quinaz…
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) | 2.92 | 9.35 | -15.64 | 0 | 7 | 0 | 62 | 469.948 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.92 | 9.87 | -40.73 | 1 | 7 | 1 | 63 | 470.956 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.92 | 9.84 | -43.42 | 1 | 7 | 1 | 63 | 470.956 | 5 | ↓ |