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Ligand

NameCHEMBL3426950
Molecular formulaC20H16BFN2O5S
IUPAC name[6-[[5-[(4-fluorophenyl)carbamoyl]pyridin-2-yl]sulfanylmethyl]-1,3-benzodioxol-5-yl]boronic acid
Molecular weight426.225
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogPNone
SynonymsBDBM150816
US8981106, 6
Inchi KeyAJEKQDSOIAHGRB-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H16BFN2O5S/c22-14-2-4-15(5-3-14)24-20(25)12-1-6-19(23-9-12)30-10-13-7-17-18(29-11-28-17)8-16(13)21(26)27/h1-9,26-27H,10-11H2,(H,24,25)
PubChem CID77844110
ChEMBLCHEMBL3426950
IUPHARN/A
BindingDB150816
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
459280C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360

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