ZD-7155   Click here for help

GtoPdb Ligand ID: 8324

Synonyms: ZD 7155 | ZD7155
PDB Ligand
Compound class: Synthetic organic
Comment: ZD-7155 is an orally active antagonist of the angiotensin II type 1 receptor. It is more potent and longer-acting than the prototype AT1 antagonist, losartan (in rats) [1].
ZD-7155 has been co-crystalised with a modified human AT1 receptor with PDB structure ID 4YAY [3].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 87.66
Molecular weight 438.22
XLogP 5.08
No. Lipinski's rules broken 1
SMILES / InChI / InChIKey
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Canonical SMILES CCc1nc(CC)c2c(c1)N(Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)C(=O)CC2
Isomeric SMILES CCc1nc(CC)c2c(c1)N(Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)C(=O)CC2
InChI InChI=1S/C26H26N6O/c1-3-19-15-24-22(23(4-2)27-19)13-14-25(33)32(24)16-17-9-11-18(12-10-17)20-7-5-6-8-21(20)26-28-30-31-29-26/h5-12,15H,3-4,13-14,16H2,1-2H3,(H,28,29,30,31)
InChI Key BFVNEYDCFJNLGN-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
5,7-diethyl-1-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-3,4-dihydro-1,6-naphthyridin-2-one
Synonyms Click here for help
ZD 7155 | ZD7155
Database Links Click here for help
CAS Registry No. 151801-76-2 (source: Scifinder)
ChEMBL Ligand CHEMBL159096
GtoPdb PubChem SID 252166536
PubChem CID 4673492
RCSB PDB Ligand ZD7
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