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Name | CHEMBL210461 |
---|---|
Molecular formula | C31H35Cl2N3O |
IUPAC name | N-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butyl]tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaene-5-carboxamide |
Molecular weight | 536.541 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 7.3 |
Synonyms | N-[4-(4-(2,3-dichlorophenyl)piperazin-1-yl]butyl][2.2]-paracyclophane-4-carboxamide BDBM50188478 |
Inchi Key | ACKGCCXJFAZCFF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C31H35Cl2N3O/c32-28-4-3-5-29(30(28)33)36-20-18-35(19-21-36)17-2-1-16-34-31(37)27-22-25-11-10-23-6-8-24(9-7-23)12-14-26(27)15-13-25/h3-9,13,15,22H,1-2,10-12,14,16-21H2,(H,34,37) |
PubChem CID | 11706497 |
ChEMBL | CHEMBL210461 |
IUPHAR | N/A |
BindingDB | 50188478 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
1658 | 5-hydroxytryptamine receptor 1A | P08908 | HTR1A | Homo sapiens (Human) | 422 |
1654 | D(1A) dopamine receptor | P21728 | DRD1 | Homo sapiens (Human) | 446 |
1656 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
1657 | D(3) dopamine receptor | P35462 | DRD3 | Homo sapiens (Human) | 400 |
1655 | D(4) dopamine receptor | P21917 | DRD4 | Homo sapiens (Human) | 467 |
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