
Common name
difluoromethanethiol
IUPAC name
difluoromethanethiol
SMILES
SC(F)F
Common name
difluoromethanethiol
IUPAC name
difluoromethanethiol
SMILES
SC(F)F
INCHI
InChI=1S/CH2F2S/c2-1(3)4/h1,4H
FORMULA
CH2F2S

Common name
difluoromethanethiol
IUPAC name
difluoromethanethiol
Molecular weight
84.088
clogP
1.794
clogS
-0.487
Frequency
0.0007
HBond Acceptor
0
HBond Donor
1
Total PolarSurface Area
38.8
Number of Rings
0
Rotatable Bond
0
2 ,
1
FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
---|---|---|---|---|---|
5alr_ligand_1_3.mol2 | 5alr | 1 | -5.63 | C(F)(F)(F)S | 5 |
4gto_ligand_1_8.mol2 | 4gto | 0.6 | -5.77 | [S](O)(O)C(F)(F)F | 7 |
4lvt_ligand_1_15.mol2 | 4lvt | 0.6 | -5.56 | C(F)(F)(F)[S](O)O | 7 |
2gh6_ligand_frag_9.mol2 | 2gh6 | 0.5 | -5.41 | C(F)(F)F | 4 |
4m3d_ligand_frag_8.mol2 | 4m3d | 0.5 | -5.38 | C(F)(F)F | 4 |
1ela_ligand_frag_1.mol2 | 1ela | 0.5 | -5.37 | C(F)(F)F | 4 |
1ele_ligand_frag_1.mol2 | 1ele | 0.5 | -5.37 | C(F)(F)F | 4 |
609 ,
61