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Name | BDBM37716 |
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Molecular formula | C14H14N4OS2 |
IUPAC name | 6-imino-4-(2-methylsulfanylethyl)-3-thiophen-2-yl-4,5-dihydro-2H-pyrano[2,3-c]pyrazole-5-carbonitrile |
Molecular weight | 318.413 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 2.5 |
Synonyms | 6-amino-4-[2-(methylthio)ethyl]-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile cid_3239805 6-azanyl-4-(2-methylsulfanylethyl)-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile 6-amino-4-[2-(methylthio)ethyl]-3-(2-thienyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
Inchi Key | ATGXFIFSVOAEFS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H14N4OS2/c1-20-6-4-8-9(7-15)13(16)19-14-11(8)12(17-18-14)10-3-2-5-21-10/h2-3,5,8-9,16H,4,6H2,1H3,(H,17,18) |
PubChem CID | 91896330 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 37716 |
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 |
---|---|---|---|---|---|
13951 | fMet-Leu-Phe receptor | P21462 | FPR1 | Homo sapiens (Human) | 350 |
13952 | N-formyl peptide receptor 2 | P25090 | FPR2 | Homo sapiens (Human) | 351 |
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