General Information of the Compound
| Compound ID |
CP0564609
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| Compound Name |
2-[(7-chloro-1H-indol-3-yl)methyl]-5-fluoro-1H-indole
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| Structure |
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| Formula |
C17H12ClFN2
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| Molecular Weight |
298.748
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| Canonical SMILES |
Fc1ccc2[nH]c(Cc3c[nH]c4c(Cl)cccc34)cc2c1
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| InChI |
InChI=1S/C17H12ClFN2/c18-15-3-1-2-14-11(9-20-17(14)15)8-13-7-10-6-12(19)4-5-16(10)21-13/h1-7,9,20-21H,8H2
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| InChIKey |
KRLSGDCZKJLPEG-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