General Information of the Compound
| Compound ID |
CP0144908
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| Compound Name |
(1R)-N-(3,5-difluoro-4-trimethylsilylphenyl)-6-methoxy-2-(3-oxo-1,2-oxazole-5-carbonyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide
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| Structure |
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| Formula |
C24H25F2N3O5Si
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| Molecular Weight |
501.562
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| Canonical SMILES |
COc1ccc2[C@@H](N(CCc2c1)C(=O)c1cc(O)no1)C(=O)Nc1cc(F)c(c(F)c1)[Si](C)(C)C
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| InChI |
InChI=1S/C24H25F2N3O5Si/c1-33-15-5-6-16-13(9-15)7-8-29(24(32)19-12-20(30)28-34-19)21(16)23(31)27-14-10-17(25)22(18(26)11-14)35(2,3)4/h5-6,9-12,21H,7-8H2,1-4H3,(H,27,31)(H,28,30)/t21-/m1/s1
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| InChIKey |
GKAMRNLJVZKSTR-OAQYLSRUSA-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