General Information of the Compound
| Compound ID |
CP0490145
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| Compound Name |
6,8-Dichloro-7-ethoxy-9H-beta-carboline
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| Formula |
C13H10Cl2N2O
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| Molecular Weight |
281.142
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| Canonical SMILES |
CCOc1c(Cl)cc2c(nc3c[nH]ccc23)c1Cl
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| InChI |
InChI=1S/C13H10Cl2N2O/c1-2-18-13-9(14)5-8-7-3-4-16-6-10(7)17-12(8)11(13)15/h3-6,16H,2H2,1H3
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| InChIKey |
BPMGVAZIHDNZRC-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