| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 2nd, 2006 | 20 | No |
Popular Name: 2-Mercapto-3-(3-methoxy-propyl)-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one 2-Mercapto-3-(3-methoxy-propyl)-…
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CAS Number: 568555-38-4
| 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) | 2.23 | 7.73 | -10.76 | 1 | 4 | 0 | 47 | 310.444 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.69 | 6.55 | -39.57 | 0 | 4 | -1 | 50 | 309.436 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
