Responsive image

Common name

benzenesulfonylbenzene

IUPAC name

benzenesulfonylbenzene

SMILES

c1(ccccc1)S(=O)(=O)c2ccccc2

Common name

benzenesulfonylbenzene

IUPAC name

benzenesulfonylbenzene

SMILES

c1(ccccc1)S(=O)(=O)c2ccccc2

INCHI

InChI=1S/C12H10O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H

FORMULA

C12H10O2S

Responsive image

Common name

benzenesulfonylbenzene

IUPAC name

benzenesulfonylbenzene





Molecular weight

218.272

clogP

2.317

clogS

-3.333

Frequency

0.0003





HBond Acceptor

2

HBond Donor

0

Total Polar
Surface Area

34.14

Number of Rings

2

Rotatable Bond

2

Drug ID Common name Structure CAS Compound class Therapeutic area
FDBD00993 Sulfoxone Responsive image Anti-Infective Agents; Sulfonamides; For the treatment of leprosy and dermatitis herpetiformis.
1 , 1
FRAGNAME PDBID SIMILIRITY XSCORE SMILE HAC
4m6q_ligand_2_9.mol2 4m6q 1 -7.50 c1(ccccc1)S(=O)(=O)c1ccccc1 15
4lts_ligand_2_0.mol2 4lts 1 -7.49 S(=O)(=O)(c1ccccc1)c1ccccc1 15
4m6p_ligand_2_0.mol2 4m6p 1 -7.49 c1(ccccc1)S(=O)(=O)c1ccccc1 15
4jnm_ligand_2_0.mol2 4jnm 1 -7.45 c1(ccccc1)S(=O)(=O)c1ccccc1 15
4o13_ligand_2_5.mol2 4o13 1 -7.44 c1(ccccc1)S(=O)(=O)c1ccccc1 15
4o15_ligand_2_5.mol2 4o15 1 -7.43 S(=O)(=O)(c1ccccc1)c1ccccc1 15
4lww_ligand_2_0.mol2 4lww 1 -7.41 S(=O)(=O)(c1ccccc1)c1ccccc1 15
4rak_ligand_1_0.mol2 4rak 0.857143 -6.96 CS(=O)(=O)c1ccccc1 10
4v24_ligand_2_0.mol2 4v24 0.857143 -6.89 O=S(=O)(c1ccccc1)C 10
126 , 13