General Information of the Compound
| Compound ID |
CP0315218
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| Compound Name |
5-[3-chloro-4-(2,5-dimethylanilino)quinolin-6-yl]pyridine-2-carbonitrile
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| Structure |
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| Formula |
C23H17ClN4
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| Molecular Weight |
384.87
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| Canonical SMILES |
Cc1ccc(C)c(Nc2c(Cl)cnc3ccc(cc23)-c2ccc(nc2)C#N)c1
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| InChI |
InChI=1S/C23H17ClN4/c1-14-3-4-15(2)22(9-14)28-23-19-10-16(6-8-21(19)27-13-20(23)24)17-5-7-18(11-25)26-12-17/h3-10,12-13H,1-2H3,(H,27,28)
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| InChIKey |
NVXKGSOVPKMURO-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