General Information of the Compound
| Compound ID |
CP0634528
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| Compound Name |
N-(benzyloxy)-2-chloro-5-(2-methyl-1-oxo-1-(4-(trifluoromethyl)-6H-thiazolo[5,4-e]indazol-2-ylamino)propan-2-ylamino)benzamide
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| Structure |
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| Formula |
C27H22ClF3N6O3S
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| Molecular Weight |
603.026
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| Canonical SMILES |
CC(C)(Nc1ccc(Cl)c(C(=O)NOCc2ccccc2)c1)C(=O)Nc1nc2c(C(F)(F)F)cc3[nH]ncc3c2s1
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| InChI |
InChI=1S/C27H22ClF3N6O3S/c1-26(2,35-15-8-9-19(28)16(10-15)23(38)37-40-13-14-6-4-3-5-7-14)24(39)34-25-33-21-18(27(29,30)31)11-20-17(12-32-36-20)22(21)41-25/h3-12,35H,13H2,1-2H3,(H,32,36)(H,37,38)(H,33,34,39)
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| InChIKey |
OZZGCHZTKBHAMX-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