General Information of the Compound
| Compound ID |
CP0384647
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| Compound Name |
3-Amino-5-(6-(2-amino-4-(trifluoromethyl)phenyl)pyrimidin-4-yloxy)quinoxalin-2(1H)-one
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| Structure |
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| Formula |
C19H13F3N6O2
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| Molecular Weight |
414.347
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| Canonical SMILES |
Nc1cc(ccc1-c1cc(Oc2cccc3[nH]c(=O)c(N)nc23)ncn1)C(F)(F)F
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| InChI |
InChI=1S/C19H13F3N6O2/c20-19(21,22)9-4-5-10(11(23)6-9)13-7-15(26-8-25-13)30-14-3-1-2-12-16(14)28-17(24)18(29)27-12/h1-8H,23H2,(H2,24,28)(H,27,29)
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| InChIKey |
QBTWRBDYIMWDCX-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