General Information of the Compound
| Compound ID |
CP0057017
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| Compound Name |
4-(5-Cyclopropyl-3-pyridin-2-yl-1H-pyrazol-4-yl)-quinoline
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| Structure |
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| Formula |
C20H16N4
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| Molecular Weight |
312.376
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| Canonical SMILES |
C1CC1c1[nH]nc(c1-c1ccnc2ccccc12)-c1ccccn1
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| InChI |
InChI=1S/C20H16N4/c1-2-6-16-14(5-1)15(10-12-22-16)18-19(13-8-9-13)23-24-20(18)17-7-3-4-11-21-17/h1-7,10-13H,8-9H2,(H,23,24)
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| InChIKey |
KUWVOCJVMUNDRT-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