SULPROSTONE


SMILES CS(=O)(=O)NC(=O)CCCC=CCC1C(C(CC1=O)O)C=CC(COC2=CC=CC=C2)O
InChIKey UQZVCDCIMBLVNR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 12
Molecular weight (Da) 465.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
EP3 PE2R3 Mouse Prostanoid A pKi 9.22 9.22 9.22 PDSP Ki database
FP PF2R Mouse Prostanoid A pKi 6.24 6.24 6.24 PDSP Ki database
EP3 PE2R3 Bovine Prostanoid A pKi 7.68 7.82 7.96 PDSP Ki database
FP PF2R Bovine Prostanoid A pKi 5.6 5.6 5.6 PDSP Ki database
EP1 PE2R1 Human Prostanoid A pKi 6.97 6.97 6.97 PDSP Ki database
EP3 PE2R3 Human Prostanoid A pKi 9.46 9.46 9.46 PDSP Ki database
EP4 PE2R4 Human Prostanoid A pKi 5.0 5.05 5.11 PDSP Ki database
DP1 PD2R Human Prostanoid A pKi 5.0 5.0 5.0 PDSP Ki database
IP PI2R Human Prostanoid A pKi 5.0 5.0 5.0 PDSP Ki database
EP1 PE2R1 Human Prostanoid A pKi 8.15 8.15 8.15 Drug Central
EP3 PE2R3 Human Prostanoid A pKi 8.02 8.02 8.02 Drug Central
EP4 PE2R4 Human Prostanoid A pKi 8.29 8.29 8.29 Drug Central
FP PF2R Human Prostanoid A pKi 8.17 8.17 8.17 Drug Central
EP1 PE2R1 Mouse Prostanoid A pKi 8.11 8.11 8.11 Drug Central
EP3 PE2R3 Mouse Prostanoid A pKi 8.04 8.04 8.04 Drug Central
EP1 PE2R1 Rat Prostanoid A pKi 8.15 8.15 8.15 Drug Central
FP PF2R Human Prostanoid A pKi 6.7 6.7 6.7 PDSP Ki database
EP1 PE2R1 Mouse Prostanoid A pKi 7.68 7.68 7.68 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
EP3 PE2R3 Rat Prostanoid A pEC50 8.03 8.03 8.03 Drug Central