Common name
(dihydroxy-λ3-sulfanyl)-difluoromethane
IUPAC name
(dihydroxy-λ3-sulfanyl)-difluoromethane
SMILES
[S](O)(O)C(F)F
Common name
(dihydroxy-λ3-sulfanyl)-difluoromethane
IUPAC name
(dihydroxy-λ3-sulfanyl)-difluoromethane
SMILES
[S](O)(O)C(F)F
INCHI
InChI=1S/CH3F2O2S/c2-1(3)6(4)5/h1,4-5H
FORMULA
CH3F2O2S
Common name
(dihydroxy-λ3-sulfanyl)-difluoromethane
IUPAC name
(dihydroxy-λ3-sulfanyl)-difluoromethane
Molecular weight
117.095
clogP
0.177
clogS
0.602
Frequency
0.0007
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 |
|---|---|---|---|---|
| FDBD01926 | flursulamid |
|
Insecticide | Insecticide |
| FDBD01929 | sulfluramid |
|
Insecticide | Insecticide |
2 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4gto_ligand_1_8.mol2 | 4gto | 1 | -5.77 | [S](O)(O)C(F)(F)F | 7 |
| 4lvt_ligand_1_15.mol2 | 4lvt | 1 | -5.56 | C(F)(F)(F)[S](O)O | 7 |
| 4oho_ligand_1_4.mol2 | 4oho | 0.642857 | -5.61 | [S@@](O)(N)C(F)(F)F | 7 |
| 4gto_ligand_2_35.mol2 | 4gto | 0.6 | -5.83 | S(=O)(=O)(O)C(F)(F)F | 8 |
| 5alr_ligand_1_3.mol2 | 5alr | 0.6 | -5.63 | C(F)(F)(F)S | 5 |
| 4rak_ligand_frag_0.mol2 | 4rak | 0.5 | -5.51 | C[S](O)O | 4 |
| 4mxc_ligand_frag_1.mol2 | 4mxc | 0.5 | -5.37 | [S](O)(O)C | 4 |
136 ,
14
