In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2008 | 24 | Yes |
Popular Name: 3-[3-(3-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanylpropanamide 3-[3-(3-methyl-2-pyridyl)-4-oxo-…
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) | 2.17 | 6.25 | -20.67 | 2 | 6 | 0 | 91 | 340.408 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 6.55 | -43.16 | 3 | 6 | 1 | 92 | 341.416 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.