CHEMBL3040324
SMILES | c1ccc(Cc2nc3c(c(Nc4ccccc4)n2)CCNCC3)cc1 |
InChIKey | QEAYWRGPVOISMK-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 330.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
5-HT7 | 5HT7R | Human | 5-Hydroxytryptamine | A | pIC50 | 5.81 | 5.81 | 5.81 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pIC50 | 5.86 | 5.86 | 5.86 | ChEMBL |
5-HT6 | 5HT6R | Human | 5-Hydroxytryptamine | A | pIC50 | 7.43 | 7.43 | 7.43 | ChEMBL |
5-HT2B | 5HT2B | Human | 5-Hydroxytryptamine | A | pIC50 | 7.05 | 7.05 | 7.05 | ChEMBL |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pIC50 | 8.7 | 8.7 | 8.7 | ChEMBL |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pEC50 | 7.7 | 7.7 | 7.7 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pIC50 | 6.57 | 6.57 | 6.57 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pIC50 | 8.57 | 8.57 | 8.57 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pEC50 | 8.21 | 8.21 | 8.21 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pIC50 | 6.4 | 6.4 | 6.4 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pIC50 | 6.83 | 6.83 | 6.83 | ChEMBL |