General Information of the Compound
| Compound ID |
CP0542905
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| Compound Name |
N-[2-[2-(4-methoxyphenyl)tetrazol-5-yl]phenyl]quinoline-3-carboxamide
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| Structure |
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| Formula |
C24H18N6O2
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| Molecular Weight |
422.448
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| Canonical SMILES |
COc1ccc(cc1)-n1nnc(n1)-c1ccccc1NC(=O)c1cnc2ccccc2c1
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| InChI |
InChI=1S/C24H18N6O2/c1-32-19-12-10-18(11-13-19)30-28-23(27-29-30)20-7-3-5-9-22(20)26-24(31)17-14-16-6-2-4-8-21(16)25-15-17/h2-15H,1H3,(H,26,31)
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| InChIKey |
FMRJSVTXIWPRJZ-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