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Ligand

NameCHEMBL490492
Molecular formulaC28H29N5O5
IUPAC nameN-(2-phenoxyethyl)-2-(pyridin-2-ylmethylamino)-4-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxamide
Molecular weight515.57
Hydrogen bond acceptor9
Hydrogen bond donor2
XlogP3.5
SynonymsBDBM27989
trisubstituted pyrimidine analogue, 6j
N-(2-phenoxyethyl)-2-[(pyridin-2-ylmethyl)amino]-4-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxamide
Inchi KeyBDDFGRUDUYYFFC-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H29N5O5/c1-35-23-15-19(16-24(36-2)26(23)37-3)25-22(27(34)30-13-14-38-21-10-5-4-6-11-21)18-32-28(33-25)31-17-20-9-7-8-12-29-20/h4-12,15-16,18H,13-14,17H2,1-3H3,(H,30,34)(H,31,32,33)
PubChem CID25218707
ChEMBLCHEMBL490492
IUPHARN/A
BindingDB27989
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
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GLASS IDNameUniProtGeneSpeciesLength
20805Extracellular calcium-sensing receptorP41180CASRHomo sapiens (Human)1078

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