General Information of the Compound
| Compound ID |
CP0485579
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| Compound Name |
N-(3-methoxyphenyl)-1,2-benzothiazol-3-amine
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| Formula |
C14H12N2OS
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| Molecular Weight |
256.33
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| Canonical SMILES |
COc1cccc(Nc2nsc3ccccc23)c1
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| InChI |
InChI=1S/C14H12N2OS/c1-17-11-6-4-5-10(9-11)15-14-12-7-2-3-8-13(12)18-16-14/h2-9H,1H3,(H,15,16)
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| InChIKey |
BJXRYJULQJEVLZ-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