CHEMBL2146813


SMILES O=c1c2ccncc2c(Cc2ccc(Cl)cc2)nn1C[C@H]1CCCN1CCCCc1ccc(OCCCN2CCCCCC2)cc1
InChIKey CIAWHNGOFJZBCL-MGBGTMOVSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 14
Molecular weight (Da) 641.4

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
α1B ADA1B Human Adrenoceptors A pKi 7.4 7.4 7.4 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.5 7.5 7.5 ChEMBL
H1 HRH1 Human Histamine A pKi 7.76 7.76 7.76 ChEMBL
H1 HRH1 Human Histamine A pKd 9.0 9.0 9.0 ChEMBL
H3 HRH3 Human Histamine A pKi 9.25 9.25 9.25 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database