General Information of the Compound
| Compound ID |
CP0565404
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| Compound Name |
(s)-2-(8-methoxy-4-oxobenzo[d][1,2,3]triazin-3 (4h)-yl)-n-(1-(4-(trifluoromethyl)phenyl)ethyl)acetamide
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| Structure |
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| Formula |
C19H17F3N4O3
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| Molecular Weight |
406.364
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| Canonical SMILES |
COc1cccc2c1nnn(CC(=O)N[C@@H](C)c1ccc(cc1)C(F)(F)F)c2=O
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| InChI |
InChI=1S/C19H17F3N4O3/c1-11(12-6-8-13(9-7-12)19(20,21)22)23-16(27)10-26-18(28)14-4-3-5-15(29-2)17(14)24-25-26/h3-9,11H,10H2,1-2H3,(H,23,27)/t11-/m0/s1
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| InChIKey |
ZEFUYBHGEMUTQJ-NSHDSACASA-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