| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 20 | No |
Popular Name: 3-[(5-methylpyrazin-2-yl)methyl]-2-sulfanyl-quinazolin-4-one 3-[(5-methylpyrazin-2-yl)methyl]…
| 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) | 1.39 | 6.31 | -13.01 | 1 | 5 | 0 | 64 | 284.344 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.12 | 5.96 | -42.78 | 0 | 5 | -1 | 61 | 283.336 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
