General Information of the Compound
| Compound ID |
CP0544163
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| Compound Name |
4-(5-chloropyridin-2-yl)-N-(1H-indazol-6-yl)piperazine-1-carboxamide
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| Structure |
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| Formula |
C17H17ClN6O
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| Molecular Weight |
356.817
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| Canonical SMILES |
Clc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccc2cn[nH]c2c1
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| InChI |
InChI=1S/C17H17ClN6O/c18-13-2-4-16(19-11-13)23-5-7-24(8-6-23)17(25)21-14-3-1-12-10-20-22-15(12)9-14/h1-4,9-11H,5-8H2,(H,20,22)(H,21,25)
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| InChIKey |
YDHVRKLICPIOOQ-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