CHEMBL315392


SMILES CC1=C(C(=O)NCCCN2CCC(c3ccccc3)(c3ccccc3)CC2)C(c2ccc([N+](=O)[O-])cc2)C(C(=O)N(C)C)=C(C)N1
InChIKey SNLNBLRAKFOCGE-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 10
Molecular weight (Da) 621.3

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 5.93 5.93 5.93 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 5.74 5.74 5.74 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.09 6.09 6.09 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.23 7.23 7.23 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 5.77 5.77 5.77 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.02 6.02 6.02 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database