General Information of the Compound
| Compound ID |
CP0906235
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| Compound Name |
SID131464289
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| Structure |
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| Formula |
C24H28F4N2O
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| Molecular Weight |
436.493
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| Canonical SMILES |
OC[C@@H]1[C@H](c2ccc(-c3ccc(F)cc3)cc2)[C@@H]2CN(CCC(F)(F)F)CCCCN12
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| InChI |
InChI=1S/C24H28F4N2O/c25-20-9-7-18(8-10-20)17-3-5-19(6-4-17)23-21-15-29(14-11-24(26,27)28)12-1-2-13-30(21)22(23)16-31/h3-10,21-23,31H,1-2,11-16H2/t21-,22+,23+/m0/s1
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| InChIKey |
UJWYROFULXWHSG-YTFSRNRJSA-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