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Ligand

NameSCHEMBL2347568
Molecular formulaC37H42N6O3
IUPAC nameN-[[(3S,5S)-3-[3-(diaminomethylideneamino)propyl]-1-(2,2-diphenylethyl)-2-oxo-1,4-diazepan-5-yl]methyl]-3-phenoxybenzamide
Molecular weight618.782
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP4.6
SynonymsUS9340517, 140
CHEMBL3905956
BDBM231754
Inchi KeyBGYBDRQRKARBIH-NHZFLZHXSA-N
Inchi IDInChI=1S/C37H42N6O3/c38-37(39)40-22-11-20-34-36(45)43(26-33(27-12-4-1-5-13-27)28-14-6-2-7-15-28)23-21-30(42-34)25-41-35(44)29-16-10-19-32(24-29)46-31-17-8-3-9-18-31/h1-10,12-19,24,30,33-34,42H,11,20-23,25-26H2,(H,41,44)(H4,38,39,40)/t30-,34-/m0/s1
PubChem CID46897821
ChEMBLCHEMBL3905956
IUPHARN/A
BindingDB231754
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
534002Melanocortin receptor 5P33032MC5RHomo sapiens (Human)325

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