General Information of the Compound
| Compound ID |
CP0954996
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| Compound Name |
N-((5-(1H-benzo[d]imidazol-2-ylthio)furan-2-yl)methyl)propan-2-amine
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| Structure |
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| Formula |
C15H17N3OS
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| Molecular Weight |
287.388
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| Canonical SMILES |
CC(C)NCc1ccc(Sc2nc3ccccc3[nH]2)o1
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| InChI |
InChI=1S/C15H17N3OS/c1-10(2)16-9-11-7-8-14(19-11)20-15-17-12-5-3-4-6-13(12)18-15/h3-8,10,16H,9H2,1-2H3,(H,17,18)
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| InChIKey |
SZTFQMNAYLWKJL-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