General Information of the Compound
| Compound ID |
CP0514866
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| Compound Name |
4-Oxo-2-[3-((E)-2-quinolin-2-yl-vinyl)-phenyl]-4H-chromene-6-carbonitrile
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| Structure |
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| Formula |
C27H16N2O2
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| Molecular Weight |
400.437
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| Canonical SMILES |
O=c1cc(oc2ccc(cc12)C#N)-c1cccc(\C=C\c2ccc3ccccc3n2)c1
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| InChI |
InChI=1S/C27H16N2O2/c28-17-19-9-13-26-23(15-19)25(30)16-27(31-26)21-6-3-4-18(14-21)8-11-22-12-10-20-5-1-2-7-24(20)29-22/h1-16H/b11-8+
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| InChIKey |
ZRRORSMHTTVGLC-DHZHZOJOSA-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