| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2004 | 16 | No |
Popular Name: 3-Butyl-2-mercapto-3H-quinazolin-4-one 3-Butyl-2-mercapto-3H-quinazolin…
Find On: PubMed — Wikipedia — Google
CAS Number: 13906-07-5
3-Butyl-2-mercaptoquinazolin-4(3H)-one
3-butyl-2-sulfanyl-3,4-dihydroquinazolin-4-one
3-butyl-2-sulfanyl-4(3H)-quinazolinone
3-Butyl-2-thioxo-2,3-dihydro-1H-quinazolin-4-one
| 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) | 2.48 | 7.71 | -10.12 | 1 | 3 | 0 | 38 | 234.324 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.20 | 7.42 | -39.26 | 0 | 3 | -1 | 35 | 233.316 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
