In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 28 | Yes |
Popular Name: 2-[(6,8-dibromo-4-oxo-3H-quinazolin-2-yl)methyl-methyl-amino]-N-(3-methoxyphenyl)acetamide 2-[(6,8-dibromo-4-oxo-3H-quinazo…
None
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) | 3.62 | 7.12 | -69.51 | 3 | 7 | 1 | 89 | 511.194 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.08 | 4.93 | -47.81 | 1 | 7 | -1 | 90 | 509.178 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.08 | 7.2 | -48.4 | 2 | 7 | 0 | 92 | 510.186 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.62 | 8.2 | -62.75 | 3 | 7 | 1 | 89 | 511.194 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.