General Information of the Compound
| Compound ID |
CP0570300
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| Compound Name |
1'-[6-cyano-5-(trifluoromethyl)pyridin-3-yl]-6-fluoro-N-methyl-3'-(2-methylpropyl)-5'-oxo-2'-sulfanylidenespiro[1,3-dihydroindene-2,4'-imidazolidine]-5-carboxamide
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| Formula |
C24H21F4N5O2S
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| Molecular Weight |
519.524
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| Canonical SMILES |
CNC(=O)c1cc2CC3(Cc2cc1F)N(CC(C)C)C(=S)N(C3=O)c1cnc(C#N)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C24H21F4N5O2S/c1-12(2)11-32-22(36)33(15-6-17(24(26,27)28)19(9-29)31-10-15)21(35)23(32)7-13-4-16(20(34)30-3)18(25)5-14(13)8-23/h4-6,10,12H,7-8,11H2,1-3H3,(H,30,34)
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| InChIKey |
GGSDYYYOPSLTGD-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