CHEMBL1223749
SMILES | Clc1cccc(N2CCN(CCCCNc3nccc4ccccc34)CC2)c1Cl |
InChIKey | DPAGUJADGMJVKD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 428.2 |
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 |
H4 | HRH4 | Human | Histamine | A | pKi | 8.28 | 8.28 | 8.28 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 7.22 | 7.22 | 7.22 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.72 | 8.12 | 8.51 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.51 | 8.51 | 8.51 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |