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Ligand

NameCHEMBL180001
Molecular formulaC30H36N4O4
IUPAC name(2S)-2-[[methyl-(4-phenoxyphenyl)carbamoyl]amino]-N-(3-morpholin-4-ylpropyl)-3-phenylpropanamide
Molecular weight516.642
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.0
SynonymsBDBM50159851
(S)-2-[3-Methyl-3-(4-phenoxy-phenyl)-ureido]-N-(3-morpholin-4-yl-propyl)-3-phenyl-propionamide
Inchi KeyANXVEUKNBZKYSA-NDEPHWFRSA-N
Inchi IDInChI=1S/C30H36N4O4/c1-33(25-13-15-27(16-14-25)38-26-11-6-3-7-12-26)30(36)32-28(23-24-9-4-2-5-10-24)29(35)31-17-8-18-34-19-21-37-22-20-34/h2-7,9-16,28H,8,17-23H2,1H3,(H,31,35)(H,32,36)/t28-/m0/s1
PubChem CID44390582
ChEMBLCHEMBL180001
IUPHARN/A
BindingDB50159851
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
9999Substance-K receptorP21452TACR2Homo sapiens (Human)398

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