General Information of the Compound
| Compound ID |
CP0425575
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| Compound Name |
US9012651, 268
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| Structure |
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| Formula |
C19H20F4N2O
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| Molecular Weight |
368.374
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| Canonical SMILES |
OCC1(CCCC1)NCc1cccc(n1)-c1ccc(F)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C19H20F4N2O/c20-16-7-6-13(10-15(16)19(21,22)23)17-5-3-4-14(25-17)11-24-18(12-26)8-1-2-9-18/h3-7,10,24,26H,1-2,8-9,11-12H2
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| InChIKey |
WPOJSUOBZSNHRN-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