General Information of the Compound
| Compound ID |
CP0471536
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| Compound Name |
1-[(3-chlorophenyl)methyl]-4-{1H-[1,2,3]triazolo[4,5-c]pyridin-6-yl}-1H-imidazole
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| Structure |
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| Formula |
C15H11ClN6
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| Molecular Weight |
310.748
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| Canonical SMILES |
Clc1cccc(Cn2cnc(c2)-c2cc3[nH]nnc3cn2)c1
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| InChI |
InChI=1S/C15H11ClN6/c16-11-3-1-2-10(4-11)7-22-8-15(18-9-22)12-5-13-14(6-17-12)20-21-19-13/h1-6,8-9H,7H2,(H,19,20,21)
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| InChIKey |
WLHOJGUAXPKUMX-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: PT02548, Histone lysine demethylase PHF8
Protein ID: PT02237, Lysine-specific demethylase 2A
Protein ID: PT03776, Lysine-specific demethylase 2B