| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2008 | 14 | No |
Popular Name: 4-(2-Dimethylamino-ethylamino)-1,1-dioxo-tetrahydro-thiophen-3-ol 4-(2-Dimethylamino-ethylamino)-1…
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CAS Numbers: 347364-76-5 , N/A
4-(2-Dimethylamino-ethylamino)-1,1-dioxo-
4-(2-Dimethylamino-ethylamino)-1,1-dioxo-tetrahydro-1lambda*6*-thiophen-3-ol
4-{[2-(dimethylamino)ethyl]amino}tetrahydrothiophene-3-ol 1,1-dioxide
DIMETHYLAMINOETHYLAMINODIOXOTETRAHYDROLAMBDA*THIOPHENO
| 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) | -1.27 | -4.4 | -56.02 | 3 | 5 | 1 | 74 | 223.318 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.27 | -5.61 | -12.94 | 2 | 5 | 0 | 70 | 222.31 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.27 | -1.39 | -102.18 | 3 | 5 | 1 | 78 | 223.318 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.27 | -3.09 | -48.02 | 3 | 5 | 1 | 71 | 223.318 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
