General Information of the Compound
| Compound ID |
CP0507134
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| Compound Name |
US9056859, 59
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| Structure |
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| Formula |
C24H23F2N3O3
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| Molecular Weight |
439.462
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| Canonical SMILES |
Cc1c2COC(=O)c2ccc1CCN1CCN(CC1)C(=O)Cc1cc(F)c(cc1F)C#N
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| InChI |
InChI=1S/C24H23F2N3O3/c1-15-16(2-3-19-20(15)14-32-24(19)31)4-5-28-6-8-29(9-7-28)23(30)12-17-10-22(26)18(13-27)11-21(17)25/h2-3,10-11H,4-9,12,14H2,1H3
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| InChIKey |
XSNLAQTXCNEVIY-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