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Name | CHEMBL3618200 |
---|---|
Molecular formula | C30H27F2N3O6S |
IUPAC name | N-[3-(4-fluorophenoxy)-5-(4-sulfamoylphenoxy)phenyl]-4-(4-fluorophenyl)-4-hydroxypiperidine-1-carboxamide |
Molecular weight | 595.618 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 3 |
XlogP | 4.1 |
Synonyms | BDBM50120583 SCHEMBL15911467 |
Inchi Key | CZCDHQVZWHDWFG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H27F2N3O6S/c31-21-3-1-20(2-4-21)30(37)13-15-35(16-14-30)29(36)34-23-17-26(40-24-7-5-22(32)6-8-24)19-27(18-23)41-25-9-11-28(12-10-25)42(33,38)39/h1-12,17-19,37H,13-16H2,(H,34,36)(H2,33,38,39) |
PubChem CID | 90309510 |
ChEMBL | CHEMBL3618200 |
IUPHAR | N/A |
BindingDB | 50120583 |
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 |
---|---|---|---|---|---|
469606 | Sphingosine 1-phosphate receptor 2 | P47752 | S1pr2 | Rattus norvegicus (Rat) | 352 |
469607 | Sphingosine 1-phosphate receptor 2 | O95136 | S1PR2 | Homo sapiens (Human) | 353 |
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