General Information of the Compound
| Compound ID |
CP0485293
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| Compound Name |
5-(2-methoxybenzyl)-8-((2-(methylamino)ethylamino)methyl)-2-(trifluoromethyl)pyrazolo[1,5-a]quinoxalin-4(5H)-one
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| Structure |
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| Formula |
C23H24F3N5O2
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| Molecular Weight |
459.472
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| Canonical SMILES |
CNCCNCc1ccc2n(Cc3ccccc3OC)c(=O)c3cc(nn3c2c1)C(F)(F)F
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| InChI |
InChI=1S/C23H24F3N5O2/c1-27-9-10-28-13-15-7-8-17-18(11-15)31-19(12-21(29-31)23(24,25)26)22(32)30(17)14-16-5-3-4-6-20(16)33-2/h3-8,11-12,27-28H,9-10,13-14H2,1-2H3
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| InChIKey |
IQABLZHKDBHKNU-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