General Information of the Compound
| Compound ID |
CP0532217
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| Compound Name |
N-(2-nitrophenyl)-5-piperazin-1-ylpyrazolo[1,5-a]pyrimidin-7-amine
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| Formula |
C16H17N7O2
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| Molecular Weight |
339.359
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| Canonical SMILES |
[O-][N+](=O)c1ccccc1Nc1cc(nc2ccnn12)N1CCNCC1
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| InChI |
InChI=1S/C16H17N7O2/c24-23(25)13-4-2-1-3-12(13)19-16-11-15(21-9-7-17-8-10-21)20-14-5-6-18-22(14)16/h1-6,11,17,19H,7-10H2
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| InChIKey |
NVTRFTNYSREHBG-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