General Information of the Compound
| Compound ID |
CP0530180
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| Compound Name |
3-[2-[2-(4-methylpiperidin-1-yl)acetyl]-3-phenyl-3,4-dihydropyrazol-5-yl]chromen-2-one
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| Structure |
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| Formula |
C26H27N3O3
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| Molecular Weight |
429.52
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| Canonical SMILES |
CC1CCN(CC(=O)N2N=C(CC2c2ccccc2)c2cc3ccccc3oc2=O)CC1
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| InChI |
InChI=1S/C26H27N3O3/c1-18-11-13-28(14-12-18)17-25(30)29-23(19-7-3-2-4-8-19)16-22(27-29)21-15-20-9-5-6-10-24(20)32-26(21)31/h2-10,15,18,23H,11-14,16-17H2,1H3
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| InChIKey |
WBWFMIWOIZJZFM-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