General Information of the Compound
| Compound ID |
CP0403423
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| Compound Name |
4-Pyridazin-3-yl-piperazine-1-carboxylic acid (6-fluoro-benzothiazol-2-yl)-amide
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| Structure |
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| Formula |
C16H15FN6OS
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| Molecular Weight |
358.402
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| Canonical SMILES |
Fc1ccc2nc(NC(=O)N3CCN(CC3)c3cccnn3)sc2c1
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| InChI |
InChI=1S/C16H15FN6OS/c17-11-3-4-12-13(10-11)25-15(19-12)20-16(24)23-8-6-22(7-9-23)14-2-1-5-18-21-14/h1-5,10H,6-9H2,(H,19,20,24)
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| InChIKey |
HRYARCJPLFCEKV-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