General Information of the Compound
| Compound ID |
CP0441991
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| Compound Name |
US8993565, 127
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| Structure |
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| Formula |
C19H20F2N4O3
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| Molecular Weight |
390.39
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| Canonical SMILES |
Cn1c(CC(=O)N2CCc3cc(F)c(F)cc23)nc(cc1=O)N1CCOCC1
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| InChI |
InChI=1S/C19H20F2N4O3/c1-23-16(22-17(11-18(23)26)24-4-6-28-7-5-24)10-19(27)25-3-2-12-8-13(20)14(21)9-15(12)25/h8-9,11H,2-7,10H2,1H3
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| InChIKey |
XEFINJXKROFCLI-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