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Ligand

NameCHEMBL70924
Molecular formulaC30H34N6O6S
IUPAC name1-[2-[6-[(4-tert-butylphenyl)sulfonylamino]-5-(2-methoxyphenoxy)-2-methylpyrimidin-4-yl]oxyethyl]-3-pyridin-2-ylurea
Molecular weight606.698
Hydrogen bond acceptor10
Hydrogen bond donor3
XlogP4.9
SynonymsSCHEMBL8322960
4-tert-Butyl-N-{5-(2-methoxy-phenoxy)-2-methyl-6-[2-(3-pyridin-2-yl-ureido)-ethoxy]-pyrimidin-4-yl}-benzenesulfonamide
BDBM50290058
Inchi KeyAHRRXSCSEHTVQL-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H34N6O6S/c1-20-33-27(36-43(38,39)22-15-13-21(14-16-22)30(2,3)4)26(42-24-11-7-6-10-23(24)40-5)28(34-20)41-19-18-32-29(37)35-25-12-8-9-17-31-25/h6-17H,18-19H2,1-5H3,(H,33,34,36)(H2,31,32,35,37)
PubChem CID19432672
ChEMBLCHEMBL70924
IUPHARN/A
BindingDB50290058
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5831Endothelin receptor type BP24530EDNRBHomo sapiens (Human)442
5830Endothelin-1 receptorP25101EDNRAHomo sapiens (Human)427

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