General Information of the Compound
| Compound ID |
CP0180992
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| Compound Name |
2-(4-aminophenyl)-1,3-benzothiazole-6-carboxylic acid
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| Structure |
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| Formula |
C14H10N2O2S
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| Molecular Weight |
270.313
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| Canonical SMILES |
Nc1ccc(cc1)-c1nc2ccc(cc2s1)C(O)=O
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| InChI |
InChI=1S/C14H10N2O2S/c15-10-4-1-8(2-5-10)13-16-11-6-3-9(14(17)18)7-12(11)19-13/h1-7H,15H2,(H,17,18)
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| InChIKey |
LTPKGLBZIVLTAJ-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