SB-203580


SMILES C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1
InChIKey CDMGBJANTYXAIV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 377.1

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
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 5.59 5.59 5.59 ChEMBL
A1 AA1R Human Adenosine A pKi 5.76 5.76 5.76 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.47 5.47 5.47 ChEMBL
5-HT4 5HT4R Guinea pig 5-Hydroxytryptamine A pKi 5.75 5.75 5.75 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M1 ACM1 Human Acetylcholine (muscarinic) A pIC50 4.97 4.97 4.97 ChEMBL
TSH TSHR Human Glycoprotein hormone A Potency 4.4 4.4 4.4 ChEMBL
A1 AA1R Human Adenosine A pIC50 5.53 5.53 5.53 ChEMBL
A2A AA2AR Human Adenosine A pIC50 5.22 5.22 5.22 ChEMBL
glucagon GLR Human Glucagon B1 pIC50 7.43 7.43 7.43 ChEMBL
5-HT4 5HT4R Guinea pig 5-Hydroxytryptamine A pIC50 4.98 4.98 4.98 ChEMBL