General Information of the Compound
| Compound ID |
CP0417186
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| Compound Name |
3-(2-benzoyl-3-phenyl-3,4-dihydropyrazol-5-yl)chromen-2-one
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| Structure |
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| Formula |
C25H18N2O3
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| Molecular Weight |
394.43
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| Canonical SMILES |
O=C(N1N=C(CC1c1ccccc1)c1cc2ccccc2oc1=O)c1ccccc1
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| InChI |
InChI=1S/C25H18N2O3/c28-24(18-11-5-2-6-12-18)27-22(17-9-3-1-4-10-17)16-21(26-27)20-15-19-13-7-8-14-23(19)30-25(20)29/h1-15,22H,16H2
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| InChIKey |
TXLIFPDJINMPKO-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