In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2008 | 32 | No |
Popular Name: 3-(2,4-dimethoxyphenyl)-2-[(4-methyl-1-piperidyl)methyl]-6-nitro-quinazolin-4-one 3-(2,4-dimethoxyphenyl)-2-[(4-me…
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) | 3.57 | 12.38 | -51.7 | 1 | 9 | 1 | 104 | 439.492 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.57 | 10.16 | -12.4 | 0 | 9 | 0 | 102 | 438.484 | 6 | ↓ |