General Information of the Compound
| Compound ID |
CP0413340
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| Compound Name |
US8772323, 19
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| Structure |
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| Formula |
C19H14FN3O2
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| Molecular Weight |
335.338
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| Canonical SMILES |
Fc1ccc(cc1)-c1nc2ccc(cc2o1)C1=NNC(=O)C2CCC12
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| InChI |
InChI=1S/C19H14FN3O2/c20-12-4-1-10(2-5-12)19-21-15-8-3-11(9-16(15)25-19)17-13-6-7-14(13)18(24)23-22-17/h1-5,8-9,13-14H,6-7H2,(H,23,24)
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| InChIKey |
AGSYOHCROJWYKG-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