General Information of the Compound
| Compound ID |
CP0556877
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| Compound Name |
US9199981, F68
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| Structure |
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| Formula |
C24H20F2N6O4
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| Molecular Weight |
494.458
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| Canonical SMILES |
Cc1ccc(cc1NC(=O)c1cnc2cc(ccn12)N1CCOC1=O)-c1noc(n1)C1CC(F)(F)C1
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| InChI |
InChI=1S/C24H20F2N6O4/c1-13-2-3-14(20-29-22(36-30-20)15-10-24(25,26)11-15)8-17(13)28-21(33)18-12-27-19-9-16(4-5-32(18)19)31-6-7-35-23(31)34/h2-5,8-9,12,15H,6-7,10-11H2,1H3,(H,28,33)
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| InChIKey |
GDCLOSAVAXCFJJ-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