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Ligand

NameCHEMBL3947631
Molecular formulaC29H39N5O4S
IUPAC name(6S,12S,16Z)-6-(2-methylpropyl)-12-(1,3-thiazol-4-ylmethyl)spiro[2-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),16,18,20-tetraene-9,1'-cyclopentane]-7,10,13-trione
Molecular weight553.722
Hydrogen bond acceptor7
Hydrogen bond donor4
XlogP3.7
SynonymsN/A
Inchi KeyBGIMKNKVMOHYEY-JZODFCAHSA-N
Inchi IDInChI=1S/C29H39N5O4S/c1-20(2)16-23-27(36)34-29(11-5-6-12-29)28(37)33-24(17-22-18-39-19-32-22)26(35)31-13-7-9-21-8-3-4-10-25(21)38-15-14-30-23/h3-4,7-10,18-20,23-24,30H,5-6,11-17H2,1-2H3,(H,31,35)(H,33,37)(H,34,36)/b9-7-/t23-,24-/m0/s1
PubChem CID134147273
ChEMBLCHEMBL3947631
IUPHARN/A
BindingDBN/A
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
548149Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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