General Information of the Compound
Compound ID |
CP0470056
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Compound Name |
US8754233, 4-Benzothiazol-2-yl-5-piperazin-1-yl-2H-pyrazol-3-ylamine
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Structure |
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Formula |
C14H16N6S
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Molecular Weight |
300.391
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Canonical SMILES |
Nc1n[nH]c(N2CCNCC2)c1-c1nc2ccccc2s1
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InChI |
InChI=1S/C14H16N6S/c15-12-11(13(19-18-12)20-7-5-16-6-8-20)14-17-9-3-1-2-4-10(9)21-14/h1-4,16H,5-8H2,(H3,15,18,19)
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InChIKey |
FIJKJYNYFHYOLF-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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