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Name | BDBM37731 |
---|---|
Molecular formula | C16H18N4O3 |
IUPAC name | methyl 2-(5-cyano-4-cyclohex-2-en-1-yl-6-imino-4,5-dihydro-2H-pyrano[2,3-c]pyrazol-3-yl)acetate |
Molecular weight | 314.345 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 2.0 |
Synonyms | methyl 2-(6-azanyl-5-cyano-4-cyclohex-2-en-1-yl-2,4-dihydropyrano[2,3-c]pyrazol-3-yl)ethanoate 2-(6-amino-5-cyano-4-cyclohex-2-en-1-yl-2,4-dihydropyrano[2,3-c]pyrazol-3-yl)acetic acid methyl ester 2-[6-amino-5-cyano-4-(1-cyclohex-2-enyl)-2,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetic acid methyl ester cid_3242657 |
Inchi Key | BRPDROSHKGEUPU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H18N4O3/c1-22-12(21)7-11-14-13(9-5-3-2-4-6-9)10(8-17)15(18)23-16(14)20-19-11/h3,5,9-10,13,18H,2,4,6-7H2,1H3,(H,19,20) |
PubChem CID | 91896331 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 37731 |
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 |
---|---|---|---|---|---|
31209 | fMet-Leu-Phe receptor | P21462 | FPR1 | Homo sapiens (Human) | 350 |
31208 | N-formyl peptide receptor 2 | P25090 | FPR2 | Homo sapiens (Human) | 351 |
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