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Name | MLS000438302 |
---|---|
Molecular formula | C20H24O5 |
IUPAC name | (3-butyl-7-methyl-6,8-dioxoisochromen-7-yl) cyclopentanecarboxylate |
Molecular weight | 344.407 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 3.6 |
Synonyms | (3-butyl-7-methyl-6,8-dioxoisochromen-7-yl) cyclopentanecarboxylate cyclopentanecarboxylic acid (3-butyl-7-methyl-6,8-dioxo-2-benzopyran-7-yl) ester NCGC00161513-01 CMLD003384 SR-01000763049-2 [ Show all ] |
Inchi Key | DFLRUMRQZKFKRX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H24O5/c1-3-4-9-15-10-14-11-17(21)20(2,18(22)16(14)12-24-15)25-19(23)13-7-5-6-8-13/h10-13H,3-9H2,1-2H3 |
PubChem CID | 16745542 |
ChEMBL | CHEMBL1558644 |
IUPHAR | N/A |
BindingDB | 76125 |
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 |
---|---|---|---|---|---|
58676 | Apelin receptor | P35414 | APLNR | Homo sapiens (Human) | 380 |
58675 | Type-1 angiotensin II receptor | P30556 | AGTR1 | Homo sapiens (Human) | 359 |
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