General Information of the Compound
| Compound ID |
CP0329945
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| Compound Name |
5-fluoro-3-[(5-fluoro-1H-indol-3-yl)methyl]-1H-indole
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| Structure |
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| Formula |
C17H12F2N2
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| Molecular Weight |
282.293
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| Canonical SMILES |
Fc1ccc2[nH]cc(Cc3c[nH]c4ccc(F)cc34)c2c1
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| InChI |
InChI=1S/C17H12F2N2/c18-12-1-3-16-14(6-12)10(8-20-16)5-11-9-21-17-4-2-13(19)7-15(11)17/h1-4,6-9,20-21H,5H2
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| InChIKey |
BEBUKYWOUXBVEE-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