CORYNANTHEINE


SMILES COC(=O)[C@@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
InChIKey BLGXFZZNTVWLAY-DKJBZYCGSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 1
Molecular weight (Da) 354.2

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
α1B ADA1B Human Adrenoceptors A pKi 6.29 6.29 6.29 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 6.6 6.6 6.6 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 6.34 6.34 6.34 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.79 6.79 6.79 ChEMBL
α1A ADA1A Human Adrenoceptors A pKd 6.6 6.6 6.6 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 6.85 7.2 7.54 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 5.91 5.91 5.91 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M1 ACM1 Rat Acetylcholine (muscarinic) A Potency 4.5 4.99 6.1 ChEMBL
TSH TSHR Human Glycoprotein hormone A Potency 5.1 5.1 5.1 ChEMBL