| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 23 | No |
Popular Name: 2-mercapto-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxylic acid 2-mercapto-4-oxo-3-(2-phenylethy…
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CAS Number: 422271-07-6
| 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) | 2.73 | 9.59 | -43.03 | 1 | 5 | -1 | 78 | 325.369 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.46 | 9.18 | -92.95 | 0 | 5 | -2 | 75 | 324.361 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 110 - 112 | Enamine Building Blocks |
| MP | 110...112 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
