CHEMBL3222095


SMILES Cc1csc(-c2nc(N)c3cc(CN4[C@@H](C)CCC[C@H]4C)sc3n2)n1
InChIKey JWUSYBDXQVHORB-TXEJJXNPSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 373.1

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
A1 AA1R Human Adenosine A pKi 6.52 6.52 6.52 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.05 7.05 7.05 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database