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Ligand

Namep-Cumaroylagmatin
Molecular formulaC14H20N4O2
IUPAC nameN-[4-(diaminomethylideneamino)butyl]-3-(4-hydroxyphenyl)prop-2-enamide
Molecular weight276.34
Hydrogen bond acceptor3
Hydrogen bond donor4
XlogP0.4
SynonymsN-(4-guanidinobutyl)-3-(4-hydroxyphenyl)prop-2-enamide
SCHEMBL5610628
AC1L996X
N-[4-(diaminomethylideneamino)butyl]-3-(4-hydroxyphenyl)prop-2-enamide
N-(4-guanidinobutyl)-3-(4-hydroxyphenyl)acrylamide
Inchi KeyAKIHYQWCLCDMMI-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H20N4O2/c15-14(16)18-10-2-1-9-17-13(20)8-5-11-3-6-12(19)7-4-11/h3-8,19H,1-2,9-10H2,(H,17,20)(H4,15,16,18)
PubChem CID440362
ChEMBLN/A
IUPHARN/A
BindingDB50302541
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
7581Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466

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