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Name | CHEMBL114201 |
---|---|
Molecular formula | C27H29N5O6S |
IUPAC name | 4-tert-butyl-N-[5-(3-methoxyphenoxy)-6-(2-pyrimidin-2-yloxyethoxy)pyrimidin-4-yl]benzenesulfonamide |
Molecular weight | 551.618 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 1 |
XlogP | 5.0 |
Synonyms | BDBM50104990 4-tert-Butyl-N-{5-(3-methoxy-phenoxy)-6-[2-(pyrimidin-2-yloxy)-ethoxy]-pyrimidin-4-yl}-benzenesulfonamide |
Inchi Key | CVAAEKLPFPRDCE-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H29N5O6S/c1-27(2,3)19-9-11-22(12-10-19)39(33,34)32-24-23(38-21-8-5-7-20(17-21)35-4)25(31-18-30-24)36-15-16-37-26-28-13-6-14-29-26/h5-14,17-18H,15-16H2,1-4H3,(H,30,31,32) |
PubChem CID | 11827768 |
ChEMBL | CHEMBL114201 |
IUPHAR | N/A |
BindingDB | 50104990 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
51304 | Endothelin-1 receptor | Q29010 | EDNRA | Sus scrofa (Pig) | 427 |
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