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Ligand

NameCHEMBL230034
Molecular formulaC24H26N4O4
IUPAC name(2S)-2-[(5-benzhydrylfuran-2-carbonyl)amino]-5-(diaminomethylideneamino)pentanoic acid
Molecular weight434.496
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP2.8
SynonymsZINC28707108
BDBM50422988
SCHEMBL14090793
Inchi KeyKQTJPESSNDKYIC-SFHVURJKSA-N
Inchi IDInChI=1S/C24H26N4O4/c25-24(26)27-15-7-12-18(23(30)31)28-22(29)20-14-13-19(32-20)21(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-6,8-11,13-14,18,21H,7,12,15H2,(H,28,29)(H,30,31)(H4,25,26,27)/t18-/m0/s1
PubChem CID17753143
ChEMBLCHEMBL230034
IUPHARN/A
BindingDB50422988
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
175880C3a anaphylatoxin chemotactic receptorQ16581C3AR1Homo sapiens (Human)482

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