General Information of the Compound
| Compound ID |
CP0376546
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| Compound Name |
ethyl 2-(3-fluoroanilino)-5-hydroxy-1H-benzo[g]indole-3-carboxylate
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| Structure |
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| Formula |
C21H17FN2O3
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| Molecular Weight |
364.376
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| Canonical SMILES |
CCOC(=O)c1c(Nc2cccc(F)c2)[nH]c2c1cc(O)c1ccccc21
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| InChI |
InChI=1S/C21H17FN2O3/c1-2-27-21(26)18-16-11-17(25)14-8-3-4-9-15(14)19(16)24-20(18)23-13-7-5-6-12(22)10-13/h3-11,23-25H,2H2,1H3
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| InChIKey |
DZVDATRQGIXTIV-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