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Name | CHEMBL3935099 |
---|---|
Molecular formula | C30H42N6O2 |
IUPAC name | N-[3-[[4-(cyclohexylcarbamoyl)piperidin-1-yl]methyl]phenyl]-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamide |
Molecular weight | 518.706 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 3.4 |
Synonyms | BDBM243741 US9428456, 1.072 |
Inchi Key | BQTGPSYKLVBZTD-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H42N6O2/c1-34-16-18-36(19-17-34)28-11-10-25(21-31-28)30(38)33-27-9-5-6-23(20-27)22-35-14-12-24(13-15-35)29(37)32-26-7-3-2-4-8-26/h5-6,9-11,20-21,24,26H,2-4,7-8,12-19,22H2,1H3,(H,32,37)(H,33,38) |
PubChem CID | 129626107 |
ChEMBL | CHEMBL3935099 |
IUPHAR | N/A |
BindingDB | 243741 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
534025 | Atypical chemokine receptor 3 | P25106 | ACKR3 | Homo sapiens (Human) | 362 |
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