General Information of the Compound
| Compound ID |
CP0951527
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| Compound Name |
(9-oxo-9H-fluorene-1,8-diyl)bis(methylene)dicarbamimidothioate hydrobromide
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| Structure |
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| Formula |
C17H17BrN4OS2
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| Molecular Weight |
437.388
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| Canonical SMILES |
Br.N=C(N)SCc1cccc2c1C(=O)c1c(CSC(=N)N)cccc1-2
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| InChI |
InChI=1S/C17H16N4OS2.BrH/c18-16(19)23-7-9-3-1-5-11-12-6-2-4-10(8-24-17(20)21)14(12)15(22)13(9)11;/h1-6H,7-8H2,(H3,18,19)(H3,20,21);1H
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| InChIKey |
DJWVZFYECSKFNB-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