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Name | CHEMBL118196 |
---|---|
Molecular formula | C34H44N2O4S |
IUPAC name | benzyl N-[1-[5-(benzenesulfonyl)-3-methyl-3-phenylhexyl]piperidin-4-yl]-N-ethylcarbamate |
Molecular weight | 576.796 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 7.0 |
Synonyms | AC1LA896 [1-(5-Benzenesulfonyl-3-methyl-3-phenyl-hexyl)-piperidin-4-yl]-ethyl-carbamic acid benzyl ester benzyl N-[1-[5-(benzenesulfonyl)-3-methyl-3-phenyl-hexyl]-4-piperidyl]-N-ethyl-carbamate BDBM50148684 [1-(5-Benzenesulfonyl-3-methyl-3-phenyl-hexyl)-piperidin-4-yl]-ethyl-carbamic acid, benzyl ester [ Show all ] |
Inchi Key | AYVFJDPITYUMTH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C34H44N2O4S/c1-4-36(33(37)40-27-29-14-8-5-9-15-29)31-20-23-35(24-21-31)25-22-34(3,30-16-10-6-11-17-30)26-28(2)41(38,39)32-18-12-7-13-19-32/h5-19,28,31H,4,20-27H2,1-3H3 |
PubChem CID | 483354 |
ChEMBL | CHEMBL118196 |
IUPHAR | N/A |
BindingDB | 50148684 |
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 |
---|---|---|---|---|---|
17819 | C-C chemokine receptor type 5 | P51681 | CCR5 | Homo sapiens (Human) | 352 |
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