General Information of the Compound
| Compound ID |
CP0533826
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| Compound Name |
N-(3-bromophenyl)-1,2-benzothiazol-3-amine
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| Formula |
C13H9BrN2S
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| Molecular Weight |
305.2
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| Canonical SMILES |
Brc1cccc(Nc2nsc3ccccc23)c1
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| InChI |
InChI=1S/C13H9BrN2S/c14-9-4-3-5-10(8-9)15-13-11-6-1-2-7-12(11)17-16-13/h1-8H,(H,15,16)
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| InChIKey |
RLEYHVXFUFILQK-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