General Information of the Compound
| Compound ID |
CP0560669
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| Compound Name |
US10668051, Compound Example 60
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| Structure |
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| Formula |
C21H18F3N3O
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| Molecular Weight |
385.389
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| Canonical SMILES |
Cc1ccccc1C(=O)Nc1ccc(cc1)-n1nc(cc1C1CC1)C(F)(F)F
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| InChI |
InChI=1S/C21H18F3N3O/c1-13-4-2-3-5-17(13)20(28)25-15-8-10-16(11-9-15)27-18(14-6-7-14)12-19(26-27)21(22,23)24/h2-5,8-12,14H,6-7H2,1H3,(H,25,28)
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| InChIKey |
FWFALJHSGGWRGC-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