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Ligand

NameCHEMBL3719296
Molecular formulaC30H33N7O4
IUPAC name(2R)-5-(diaminomethylideneamino)-2-[5-(morpholine-4-carbonyl)-2-(3-phenoxyphenyl)benzimidazol-1-yl]pentanamide
Molecular weight555.639
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP2.0
SynonymsSCHEMBL14020539
Inchi KeyHEACHFYTODVTGR-AREMUKBSSA-N
Inchi IDInChI=1S/C30H33N7O4/c31-27(38)26(10-5-13-34-30(32)33)37-25-12-11-21(29(39)36-14-16-40-17-15-36)19-24(25)35-28(37)20-6-4-9-23(18-20)41-22-7-2-1-3-8-22/h1-4,6-9,11-12,18-19,26H,5,10,13-17H2,(H2,31,38)(H4,32,33,34)/t26-/m1/s1
PubChem CID89224504
ChEMBLCHEMBL3719296
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
524769Mas-related G-protein coupled receptor member X1Q96LB2MRGPRX1Homo sapiens (Human)322
524770Mas-related G-protein coupled receptor member X2Q96LB1MRGPRX2Homo sapiens (Human)330

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