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Ligand

NameCHEMBL387686
Molecular formulaC17H18Cl2N4O4
IUPAC name(2R)-5-(diaminomethylideneamino)-2-[[5-(2,5-dichlorophenyl)furan-2-carbonyl]amino]pentanoic acid
Molecular weight413.255
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP2.3
SynonymsBDBM50422995
Inchi KeyBMFDMQDESJMJEZ-GFCCVEGCSA-N
Inchi IDInChI=1S/C17H18Cl2N4O4/c18-9-3-4-11(19)10(8-9)13-5-6-14(27-13)15(24)23-12(16(25)26)2-1-7-22-17(20)21/h3-6,8,12H,1-2,7H2,(H,23,24)(H,25,26)(H4,20,21,22)/t12-/m1/s1
PubChem CID44426466
ChEMBLCHEMBL387686
IUPHARN/A
BindingDB50422995
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
27418C3a anaphylatoxin chemotactic receptorQ16581C3AR1Homo sapiens (Human)482

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