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Ligand

NameCHEMBL3426944
Molecular formulaC20H15BF4N2O4S
IUPAC name[2-[[5-[(4-fluorophenyl)carbamoyl]pyridin-2-yl]sulfanylmethyl]-4-(trifluoromethoxy)phenyl]boronic acid
Molecular weight466.214
Hydrogen bond acceptor10
Hydrogen bond donor3
XlogPNone
SynonymsSCHEMBL13197144
BDBM150812
US8981106, 2 (SX-576)
Inchi KeyAEDMWJARWOMJKQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H15BF4N2O4S/c22-14-2-4-15(5-3-14)27-19(28)12-1-8-18(26-10-12)32-11-13-9-16(31-20(23,24)25)6-7-17(13)21(29)30/h1-10,29-30H,11H2,(H,27,28)
PubChem CID46897163
ChEMBLCHEMBL3426944
IUPHARN/A
BindingDB150812
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
441843C-X-C chemokine receptor type 1P25024CXCR1Homo sapiens (Human)350
441844C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360

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