General Information of the Compound
| Compound ID |
CP0473808
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| Compound Name |
2-[5-(4-fluoronaphthalen-1-yl)-1- methylimidazol-4-yl]-4-(2H- tetrazol-5-yl)pyridine
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| Structure |
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| Formula |
C20H14FN7
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| Molecular Weight |
371.379
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| Canonical SMILES |
Cn1cnc(c1-c1ccc(F)c2ccccc12)-c1cc(ccn1)-c1nn[nH]n1
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| InChI |
InChI=1S/C20H14FN7/c1-28-11-23-18(17-10-12(8-9-22-17)20-24-26-27-25-20)19(28)15-6-7-16(21)14-5-3-2-4-13(14)15/h2-11H,1H3,(H,24,25,26,27)
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| InChIKey |
QYGSSBGCBQNYDV-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT03776, Lysine-specific demethylase 2B
Protein ID: PT02979, Lysine-specific demethylase 4C