dimethyl-W84


SMILES Cc1cccc2c1C(=O)N(C2=O)CCC[N+](CCCCCC[N+](CCCN1C(=O)c2c(C1=O)c(C)ccc2)(C)C)(C)C
InChIKey HMXRJKOINNJHNS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 15
Molecular weight (Da) 576.4

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NPS NPSR1 Human Neuropeptide S A Potency 4.5 4.5 4.5 ChEMBL
chemerin CML1 Human Chemerin receptor A pIC50 6.43 6.43 6.43 Guide to Pharmacology
TSH TSHR Human Glycoprotein hormone A Potency 4.4 4.4 4.4 ChEMBL