| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2011 | 21 | No |
Popular Name: 3-[4-(methylsulfanyl)benzyl]-2-sulfanyl-4(3H)-quinazolinone 3-[4-(methylsulfanyl)benzyl]-2-s…
| 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) | 3.52 | 8.78 | -39.32 | 0 | 3 | -1 | 41 | 313.427 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 10.03 | -10.59 | 1 | 3 | 0 | 38 | 314.435 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
