General Information of the Compound
| Compound ID |
CP0560620
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| Compound Name |
US8741923, 38
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| Structure |
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| Formula |
C26H27F3N4O3
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| Molecular Weight |
500.521
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| Canonical SMILES |
CC1CCCCN1c1ccc(cc1C(F)(F)F)-c1nc(no1)-c1ccc2CCN(CC(O)=O)Cc2c1
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| InChI |
InChI=1S/C26H27F3N4O3/c1-16-4-2-3-10-33(16)22-8-7-19(13-21(22)26(27,28)29)25-30-24(31-36-25)18-6-5-17-9-11-32(15-23(34)35)14-20(17)12-18/h5-8,12-13,16H,2-4,9-11,14-15H2,1H3,(H,34,35)
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| InChIKey |
RXXGDFABSRPZNI-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