General Information of the Compound
| Compound ID |
CP0852860
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| Compound Name |
SID56324973
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| Structure |
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| Formula |
C20H23F3N2O
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| Molecular Weight |
364.411
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| Canonical SMILES |
CC1CCc2[nH]c3ccc(C(=O)N4CCCC(C(F)(F)F)C4)cc3c2C1
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| InChI |
InChI=1S/C20H23F3N2O/c1-12-4-6-17-15(9-12)16-10-13(5-7-18(16)24-17)19(26)25-8-2-3-14(11-25)20(21,22)23/h5,7,10,12,14,24H,2-4,6,8-9,11H2,1H3
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| InChIKey |
IIJWBSVNEMEXOM-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
Protein ID: PT06109, Geminin
Protein ID: PT06172, Mothers against decapentaplegic homolog 3