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Ligand

NameCHEMBL2336416
Molecular formulaC34H42BrN7O5
IUPAC nameN-[(2R)-3-(4-bromo-2-oxo-3H-1,3-benzoxazol-6-yl)-1-oxo-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-yl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide
Molecular weight708.658
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP3.4
SynonymsBDBM50430066
SCHEMBL3591400
Inchi KeyBEZLXEJGNUZTPC-MUUNZHRXSA-N
Inchi IDInChI=1S/C34H42BrN7O5/c35-26-18-22(20-29-30(26)38-34(46)47-29)19-28(31(43)40-14-8-24(9-15-40)39-12-4-1-5-13-39)37-32(44)41-16-10-25(11-17-41)42-21-23-6-2-3-7-27(23)36-33(42)45/h2-3,6-7,18,20,24-25,28H,1,4-5,8-17,19,21H2,(H,36,45)(H,37,44)(H,38,46)/t28-/m1/s1
PubChem CID11377534
ChEMBLCHEMBL2336416
IUPHARN/A
BindingDB50430066
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
22063Calcitonin gene-related peptide type 1 receptorQ16602CALCRLHomo sapiens (Human)461

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