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Ligand

NameCHEMBL3126694
Molecular formulaC23H21Cl2N3O5S
IUPAC name2-chloro-N-[4-chloro-3-[(4-ethoxyphenyl)carbamoylamino]phenyl]-4-methylsulfonylbenzamide
Molecular weight522.397
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP4.2
SynonymsN/A
Inchi KeyBMEGXELSMXJHNR-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H21Cl2N3O5S/c1-3-33-16-7-4-14(5-8-16)27-23(30)28-21-12-15(6-11-19(21)24)26-22(29)18-10-9-17(13-20(18)25)34(2,31)32/h4-13H,3H2,1-2H3,(H,26,29)(H2,27,28,30)
PubChem CID76329082
ChEMBLCHEMBL3126694
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
27405Smoothened homologQ99835SMOHomo sapiens (Human)787

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