Common name
(dihydroxy-λ3-sulfanyl)ethane
IUPAC name
(dihydroxy-λ3-sulfanyl)ethane
SMILES
C(C)[S](O)O
Common name
(dihydroxy-λ3-sulfanyl)ethane
IUPAC name
(dihydroxy-λ3-sulfanyl)ethane
SMILES
C(C)[S](O)O
INCHI
InChI=1S/C2H7O2S/c1-2-5(3)4/h3-4H,2H2,1H3
FORMULA
C2H7O2S
Common name
(dihydroxy-λ3-sulfanyl)ethane
IUPAC name
(dihydroxy-λ3-sulfanyl)ethane
Molecular weight
95.141
clogP
-1.711
clogS
0.452
Frequency
0.0055
HBond Acceptor
2
HBond Donor
2
Total PolarSurface Area
40.46
Number of Rings
0
Rotatable Bond
1
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD02821 | rimsulfuron |
|
Herbicide | Herbicide |
| FDBD02823 | sulfosulfuron |
|
Herbicide | Herbicide |
| FDBD02838 | buthiuron |
|
Herbicide | Herbicide |
| FDBD02839 | ethidimuron |
|
Herbicide | Herbicide |
| FDBD03247 | ethylicin |
|
Fungicide | Fungicide |
| FDBD03267 | sultropen |
|
Fungicide | Fungicide |
16 ,
2
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 3blt_ligand_1_2.mol2 | 3blt | 1 | -5.88 | C(C)[S](O)O | 5 |
| 3blu_ligand_1_0.mol2 | 3blu | 1 | -5.88 | [S](O)(O)CC | 5 |
| 4nie_ligand_1_10.mol2 | 4nie | 1 | -5.83 | [S](O)(O)CC | 5 |
| 4xt9_ligand_1_3.mol2 | 4xt9 | 1 | -5.81 | C(C)[S](O)O | 5 |
| 3bm8_ligand_1_2.mol2 | 3bm8 | 1 | -5.73 | [S](O)(O)CC | 5 |
| 2hhn_ligand_2_12.mol2 | 2hhn | 1 | -5.56 | O[S](O)CC | 5 |
| 2hh5_ligand_2_12.mol2 | 2hh5 | 1 | -5.53 | CC[S](O)O | 5 |
228 ,
23
