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Name | CHEMBL2158005 |
---|---|
Molecular formula | C17H10ClN3O6S |
IUPAC name | [4-oxo-6-(pyrimidin-2-ylsulfanylmethyl)pyran-3-yl] 2-chloro-5-nitrobenzoate |
Molecular weight | 419.792 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 0 |
XlogP | 2.8 |
Synonyms | SR-01000020415-1 BDBM50393907 F2510-0136 MolPort-003-127-658 877636-54-9 [ Show all ] |
Inchi Key | CVGXGMFNRHYEOK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H10ClN3O6S/c18-13-3-2-10(21(24)25)6-12(13)16(23)27-15-8-26-11(7-14(15)22)9-28-17-19-4-1-5-20-17/h1-8H,9H2 |
PubChem CID | 18572337 |
ChEMBL | CHEMBL2158005 |
IUPHAR | N/A |
BindingDB | 50393907 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
51443 | Apelin receptor | P35414 | APLNR | Homo sapiens (Human) | 380 |
51444 | Type-1 angiotensin II receptor | P30556 | AGTR1 | Homo sapiens (Human) | 359 |
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