ralinepag


SMILES C1CC(CCC1COCC(=O)O)COC(=O)N(C2=CC=CC=C2)C3=CC=C(C=C3)Cl
InChIKey NPDKXVKJRHPDQT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 431.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
EP3 PE2R3 Human Prostanoid A pKi 6.84 6.84 6.84 Guide to Pharmacology
IP PI2R Human Prostanoid A pKi 8.52 8.52 8.52 ChEMBL
DP1 PD2R Human Prostanoid A pKi 5.58 5.58 5.58 ChEMBL
EP1 PE2R1 Human Prostanoid A pKi 5.02 5.02 5.02 ChEMBL
EP2 PE2R2 Human Prostanoid A pKi 6.21 6.21 6.21 ChEMBL
EP3 PE2R3 Human Prostanoid A pKi 6.84 6.84 6.84 ChEMBL
EP4 PE2R4 Human Prostanoid A pKi 6.17 6.17 6.17 ChEMBL
IP PI2R Rat Prostanoid A pKi 7.12 7.12 7.12 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
IP PI2R Human Prostanoid A pIC50 6.78 7.1 7.42 ChEMBL
IP PI2R Human Prostanoid A pEC50 7.34 8.14 8.57 ChEMBL
DP1 PD2R Human Prostanoid A pEC50 6.01 6.04 6.07 ChEMBL
IP PI2R Rat Prostanoid A pEC50 6.25 6.27 6.28 ChEMBL