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Name | CHEMBL374527 |
---|---|
Molecular formula | C31H38N4O5S |
IUPAC name | 3-pyrrolidin-1-ylpropyl 4-[[4-[(2-methylbenzoyl)amino]naphthalen-1-yl]sulfonylamino]piperidine-1-carboxylate |
Molecular weight | 578.728 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 4.7 |
Synonyms | BDBM50203869 3-pyrrolidin-1-ylpropyl 4-[({4-[(2-methylbenzoyl)amino]-1-naphthyl}sulfonyl)amino]piperidine-1-carboxylate |
Inchi Key | BRFSLLFZOHATFX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C31H38N4O5S/c1-23-9-2-3-10-25(23)30(36)32-28-13-14-29(27-12-5-4-11-26(27)28)41(38,39)33-24-15-20-35(21-16-24)31(37)40-22-8-19-34-17-6-7-18-34/h2-5,9-14,24,33H,6-8,15-22H2,1H3,(H,32,36) |
PubChem CID | 16105817 |
ChEMBL | CHEMBL374527 |
IUPHAR | N/A |
BindingDB | 50203869 |
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 |
---|---|---|---|---|---|
30950 | C-C chemokine receptor type 8 | P51685 | CCR8 | Homo sapiens (Human) | 355 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218