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Ligand

NameCHEMBL3736115
Molecular formulaC24H34N6O6
IUPAC name(2S)-5-(diaminomethylideneamino)-2-[[2-[(1S)-1-[(3-methoxybenzoyl)amino]-3-methylbutyl]-5-methyl-1,3-oxazole-4-carbonyl]amino]pentanoic acid
Molecular weight502.572
Hydrogen bond acceptor8
Hydrogen bond donor5
XlogP1.6
SynonymsSCHEMBL14952353
Inchi KeyHXXFRBRLJLGXNV-ROUUACIJSA-N
Inchi IDInChI=1S/C24H34N6O6/c1-13(2)11-18(29-20(31)15-7-5-8-16(12-15)35-4)22-30-19(14(3)36-22)21(32)28-17(23(33)34)9-6-10-27-24(25)26/h5,7-8,12-13,17-18H,6,9-11H2,1-4H3,(H,28,32)(H,29,31)(H,33,34)(H4,25,26,27)/t17-,18-/m0/s1
PubChem CID89570460
ChEMBLCHEMBL3736115
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
525200C3a anaphylatoxin chemotactic receptorQ16581C3AR1Homo sapiens (Human)482

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