General Information of the Compound
| Compound ID |
CP0388183
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| Compound Name |
CHEMBL482174
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| Formula |
C20H28F3N3O2S
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| Molecular Weight |
431.524
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| Canonical SMILES |
CC1(C)[C@H]2CC[C@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)CC2
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| InChI |
InChI=1S/C20H28F3N3O2S/c1-18(2)15-5-7-19(18,8-6-15)14-29(27,28)26-11-9-25(10-12-26)17-4-3-16(13-24-17)20(21,22)23/h3-4,13,15H,5-12,14H2,1-2H3/t15-,19+
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| InChIKey |
YOFHEOGLZMYUJI-GLRZTSSQSA-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