LP-44


SMILES CSc1ccccc1N1CCN(CC1)CCCCCC(=O)NC1CCCc2c1cccc2
InChIKey JNBBJUHCODFLEG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 451.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.28 7.28 7.28 Guide to Pharmacology
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.49 6.49 6.49 Guide to Pharmacology
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 9.66 9.66 9.66 Guide to Pharmacology
D2 DRD2 Human Dopamine A pKi 8.14 8.14 8.14 Guide to Pharmacology
5-HT7 5HT7R Rat 5-Hydroxytryptamine A pKi 9.66 9.66 9.66 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKd 7.7 7.7 7.7 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 9.66 9.66 9.66 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 7.28 7.28 7.28 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.28 7.28 7.28 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.14 8.14 8.14 ChEMBL
D2 DRD2 Bovine Dopamine A pKi 8.14 8.14 8.14 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT7 5HT7R Human 5-Hydroxytryptamine A pEC50 5.59 5.59 5.59 ChEMBL