In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2009 | 31 | Yes |
Popular Name: 3-(3-methoxyphenyl)-2,4-dioxo-N-[2-(1-piperidyl)ethyl]-1H-quinazoline-7-carboxamide 3-(3-methoxyphenyl)-2,4-dioxo-N-…
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) | 2.32 | 8.05 | -58.09 | 3 | 8 | 1 | 98 | 423.493 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.78 | 4.67 | -53.92 | 1 | 8 | -1 | 100 | 421.477 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.78 | 6.95 | -79.15 | 2 | 8 | 0 | 101 | 422.485 | 6 | ↓ |