General Information of the Compound
| Compound ID |
CP0420724
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| Compound Name |
3-[[2,6-difluoro-4-(2-methylindazol-4-yl)phenyl]methyl]quinazolin-4-one
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| Structure |
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| Formula |
C23H16F2N4O
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| Molecular Weight |
402.404
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| Canonical SMILES |
Cn1cc2c(cccc2n1)-c1cc(F)c(Cn2cnc3ccccc3c2=O)c(F)c1
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| InChI |
InChI=1S/C23H16F2N4O/c1-28-11-17-15(6-4-8-22(17)27-28)14-9-19(24)18(20(25)10-14)12-29-13-26-21-7-3-2-5-16(21)23(29)30/h2-11,13H,12H2,1H3
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| InChIKey |
BSPQQUALYZXPRE-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