MRE-269


SMILES OC(=O)COCCCCN(c1cnc(c(n1)c1ccccc1)c1ccccc1)C(C)C
InChIKey OJQMKCBWYCWFPU-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 11
Molecular weight (Da) 419.2

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
EP2 PE2R2 Human Prostanoid A pKi 5.24 5.24 5.24 Guide to Pharmacology
EP4 PE2R4 Human Prostanoid A pKi 5.31 5.31 5.31 Guide to Pharmacology
IP PI2R Rat Prostanoid A pKi 6.66 6.66 6.66 Guide to Pharmacology
IP PI2R Human Prostanoid A pKi 7.7 7.7 7.7 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
DP1 PD2R Human Prostanoid A pEC50 6.81 6.81 6.81 ChEMBL
IP PI2R Human Prostanoid A pIC50 6.54 6.54 6.54 ChEMBL
IP PI2R Human Prostanoid A pEC50 7.66 7.66 7.66 ChEMBL