CHEMBL3354073


SMILES O=C1CCc2ccccc2N1CCCN1CCC(CCCCCO)CC1
InChIKey QKTOQRPNKITPLN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 358.3

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
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 5.34 5.34 5.34 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 6.35 6.35 6.35 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 5.72 5.72 5.72 ChEMBL
D4 DRD4 Human Dopamine A pKi 8.36 8.36 8.36 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 6.22 6.22 6.22 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 6.33 6.33 6.33 ChEMBL
D3 DRD3 Human Dopamine A pKi 6.17 6.17 6.17 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.93 5.93 5.93 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M4 ACM4 Human Acetylcholine (muscarinic) A pIC50 4.91 5.39 5.79 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pEC50 5.7 5.7 5.7 ChEMBL
D4 DRD4 Human Dopamine A pIC50 6.82 6.86 6.9 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pIC50 4.58 5.71 7.54 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pEC50 6.69 6.82 6.95 ChEMBL