General Information of the Compound
| Compound ID |
CP0290437
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| Compound Name |
4-(3-(5-chloropyridin-2-yl)-1H-pyrazol-4-yl)quinoline
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| Structure |
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| Formula |
C17H11ClN4
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| Molecular Weight |
306.756
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| Canonical SMILES |
Clc1ccc(nc1)-c1n[nH]cc1-c1ccnc2ccccc12
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| InChI |
InChI=1S/C17H11ClN4/c18-11-5-6-16(20-9-11)17-14(10-21-22-17)12-7-8-19-15-4-2-1-3-13(12)15/h1-10H,(H,21,22)
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| InChIKey |
NUTSQHHREHYTAX-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