General Information of the Compound
| Compound ID |
CP0466121
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| Compound Name |
5,7-difluoro-2,2-dimethyl-6-(3-methyl-1H-indol-7-yl)-2,3-dihydroquinolin-4(1H)-one O-benzyl oxime
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| Structure |
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| Formula |
C27H25F2N3O
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| Molecular Weight |
445.513
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| Canonical SMILES |
Cc1c[nH]c2c(cccc12)-c1c(F)cc2NC(C)(C)C\C(=N/OCc3ccccc3)c2c1F
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| InChI |
InChI=1S/C27H25F2N3O/c1-16-14-30-26-18(16)10-7-11-19(26)23-20(28)12-21-24(25(23)29)22(13-27(2,3)31-21)32-33-15-17-8-5-4-6-9-17/h4-12,14,30-31H,13,15H2,1-3H3/b32-22+
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| InChIKey |
AWWXSWMNIGJPHA-WEMUVCOSSA-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