BUTAPROST


SMILES CCCC1([C@H](O)C/C=C/[C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)OC)CCC1
InChIKey XRISENIKJUKIHD-LHQZMKCDSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 13
Molecular weight (Da) 408.3

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
EP2 PE2R2 Human Prostanoid A pKi 5.62 6.51 6.96 ChEMBL
EP2 PE2R2 Mouse Prostanoid A pKi 6.96 6.96 6.96 PDSP Ki database
EP3 PE2R3 Bovine Prostanoid A pKi 5.0 5.0 5.0 PDSP Ki database
EP1 PE2R1 Human Prostanoid A pKi 5.0 5.0 5.0 PDSP Ki database
EP3 PE2R3 Human Prostanoid A pKi 5.0 5.39 5.78 PDSP Ki database
EP4 PE2R4 Human Prostanoid A pKi 5.0 5.62 7.04 PDSP Ki database
FP PF2R 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
DP1 PD2R Human Prostanoid A pKi 5.0 5.0 5.0 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
IP PI2R Human Prostanoid A pIC50 7.43 7.43 7.43 ChEMBL
EP2 PE2R2 Human Prostanoid A pEC50 7.48 7.48 7.48 ChEMBL