| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 13 | No |
Popular Name: 1,4-diethyl 2-sulfanylbutanedioate 1,4-diethyl 2-sulfanylbutanedioate
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CAS Number: 23060-14-2
| 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) | 1.06 | 5.64 | -5.55 | 0 | 4 | 0 | 53 | 206.263 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 6.18 | -45.96 | 0 | 4 | -1 | 53 | 205.255 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
