General Information of the Compound
| Compound ID |
CP0495390
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| Compound Name |
8-(3,5-dichloro-pyridin-4-ylmethoxy)-2-methyl-4-(2H-pyrazol-3-yl)-quinoline
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| Structure |
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| Formula |
C19H14Cl2N4O
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| Molecular Weight |
385.254
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| Canonical SMILES |
Cc1cc(-c2cc[nH]n2)c2cccc(OCc3c(Cl)cncc3Cl)c2n1
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| InChI |
InChI=1S/C19H14Cl2N4O/c1-11-7-13(17-5-6-23-25-17)12-3-2-4-18(19(12)24-11)26-10-14-15(20)8-22-9-16(14)21/h2-9H,10H2,1H3,(H,23,25)
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| InChIKey |
HGKHCMBRRQIQQF-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