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Ligand

NameCHEMBL3343991
Molecular formulaC16H24N6O2
IUPAC name(2S,4S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-4-[(diaminomethylideneamino)methyl]pyrrolidine-2-carboxamide
Molecular weight332.408
Hydrogen bond acceptor4
Hydrogen bond donor5
XlogP-1.0
SynonymsN/A
Inchi KeyBFLKQEFSKSGPPF-AVGNSLFASA-N
Inchi IDInChI=1S/C16H24N6O2/c17-14(23)12(6-10-4-2-1-3-5-10)22-15(24)13-7-11(8-20-13)9-21-16(18)19/h1-5,11-13,20H,6-9H2,(H2,17,23)(H,22,24)(H4,18,19,21)/t11-,12-,13-/m0/s1
PubChem CID118717465
ChEMBLCHEMBL3343991
IUPHARN/A
BindingDBN/A
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
442530Mas-related G-protein coupled receptor member X1Q8CIP3Mrgprx1Mus musculus (Mouse)322
442531Mas-related G-protein coupled receptor member X1Q96LB2MRGPRX1Homo sapiens (Human)322
442532Mas-related G-protein coupled receptor member X1Q8R4G1Mrgprx1Rattus norvegicus (Rat)323

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