CHEMBL426387


SMILES O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(Br)cc(F)cc21
InChIKey XSQAICBCYIFUQS-GFCCVEGCSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 435.0

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
FP PF2R Human Prostanoid A pKi 4.85 4.85 4.85 ChEMBL
IP PI2R Human Prostanoid A pKi 6.4 6.4 6.4 ChEMBL
DP1 PD2R Human Prostanoid A pKi 8.82 8.82 8.82 ChEMBL
EP1 PE2R1 Human Prostanoid A pKi 5.36 5.36 5.36 ChEMBL
EP2 PE2R2 Human Prostanoid A pKi 6.39 6.39 6.39 ChEMBL
EP3 PE2R3 Human Prostanoid A pKi 6.33 6.33 6.33 ChEMBL
EP4 PE2R4 Human Prostanoid A pKi 5.36 5.36 5.36 ChEMBL
TP TA2R Human Prostanoid A pKi 9.08 9.08 9.08 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
DP1 PD2R Human Prostanoid A pIC50 7.64 8.62 9.59 ChEMBL
TP TA2R Human Prostanoid A pIC50 7.1 7.1 7.1 ChEMBL