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Name | CHEMBL3828187 |
---|---|
Molecular formula | C27H34ClNO6 |
IUPAC name | (1S,1aS,6bR)-6-[(1R)-1-[(2R)-3-[[1-(2-chloro-4-methoxyphenyl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]ethyl]-3-methyl-1a,6b-dihydro-1H-cyclopropa[b][1]benzofuran-1-carboxylic acid |
Molecular weight | 504.02 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 1.4 |
Synonyms | SCHEMBL18167618 BDBM50190148 |
Inchi Key | AJYPYZIFYPVAAG-WUFDQLBWSA-N |
Inchi ID | InChI=1S/C27H34ClNO6/c1-14-6-9-19(21-22-23(26(31)32)25(22)35-24(14)21)15(2)34-13-17(30)12-29-27(3,4)11-16-7-8-18(33-5)10-20(16)28/h6-10,15,17,22-23,25,29-30H,11-13H2,1-5H3,(H,31,32)/t15-,17-,22+,23+,25+/m1/s1 |
PubChem CID | 122636679 |
ChEMBL | CHEMBL3828187 |
IUPHAR | N/A |
BindingDB | 50190148 |
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 |
---|---|---|---|---|---|
521660 | Extracellular calcium-sensing receptor | P41180 | CASR | Homo sapiens (Human) | 1078 |
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