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Name | CHEMBL553089 |
---|---|
Molecular formula | C29H29ClN2O4S |
IUPAC name | N-[[1-(3,4-dimethoxyphenyl)sulfonylindol-2-yl]methyl]-1-naphthalen-1-ylethanamine;hydrochloride |
Molecular weight | 537.071 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | None |
Synonyms | N/A |
Inchi Key | BLNYQEZJKRMJNC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H28N2O4S.ClH/c1-20(25-13-8-11-21-9-4-6-12-26(21)25)30-19-23-17-22-10-5-7-14-27(22)31(23)36(32,33)24-15-16-28(34-2)29(18-24)35-3;/h4-18,20,30H,19H2,1-3H3;1H |
PubChem CID | 45261532 |
ChEMBL | CHEMBL553089 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
26837 | Extracellular calcium-sensing receptor | P48442 | Casr | Rattus norvegicus (Rat) | 1079 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417