General Information of the Compound
| Compound ID |
CP0502750
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| Compound Name |
7-fluoro-N-[1-(1H-indol-6-ylmethyl)piperidin-4-yl]-4-oxochromene-2-carboxamide
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| Structure |
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| Formula |
C24H22FN3O3
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| Molecular Weight |
419.456
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| Canonical SMILES |
Fc1ccc2c(c1)oc(cc2=O)C(=O)NC1CCN(Cc2ccc3cc[nH]c3c2)CC1
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| InChI |
InChI=1S/C24H22FN3O3/c25-17-3-4-19-21(29)13-23(31-22(19)12-17)24(30)27-18-6-9-28(10-7-18)14-15-1-2-16-5-8-26-20(16)11-15/h1-5,8,11-13,18,26H,6-7,9-10,14H2,(H,27,30)
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| InChIKey |
JQTAYQKKSGXRPR-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