General Information of the Compound
| Compound ID |
CP0541857
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| Compound Name |
US8653125, Ia-14
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| Formula |
C26H25FN2O2
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| Molecular Weight |
416.496
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| Canonical SMILES |
Fc1ccccc1-c1cccc(NC(=O)[C@@H]2CC[C@@H](CC2)NC(=O)c2ccccc2)c1
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| InChI |
InChI=1S/C26H25FN2O2/c27-24-12-5-4-11-23(24)20-9-6-10-22(17-20)29-26(31)19-13-15-21(16-14-19)28-25(30)18-7-2-1-3-8-18/h1-12,17,19,21H,13-16H2,(H,28,30)(H,29,31)/t19-,21+
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| InChIKey |
LTWJKLJPPJDNGM-TYKWCNGQSA-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