General Information of the Compound
| Compound ID |
CP0882034
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| Compound Name |
SID99495763
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| Structure |
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| Formula |
C17H13F3N2O3
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| Molecular Weight |
350.296
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| Canonical SMILES |
O=C(O)C(F)(F)F.Oc1cccc2cc(Nc3ccccc3)cnc12
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| InChI |
InChI=1S/C15H12N2O.C2HF3O2/c18-14-8-4-5-11-9-13(10-16-15(11)14)17-12-6-2-1-3-7-12;3-2(4,5)1(6)7/h1-10,17-18H;(H,6,7)
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| InChIKey |
GJCZEKIWPPBDBV-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