General Information of the Compound
| Compound ID |
CP0535071
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| Compound Name |
3-(2,4-dichlorophenyl)-N-hexyl-2,5-dimethylpyrazolo[4,3-d]pyrimidin-7-amine
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| Structure |
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| Formula |
C19H23Cl2N5
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| Molecular Weight |
392.334
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| Canonical SMILES |
CCCCCCNc1nc(C)nc2c(-c3ccc(Cl)cc3Cl)n(C)nc12
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| InChI |
InChI=1S/C19H23Cl2N5/c1-4-5-6-7-10-22-19-17-16(23-12(2)24-19)18(26(3)25-17)14-9-8-13(20)11-15(14)21/h8-9,11H,4-7,10H2,1-3H3,(H,22,23,24)
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| InChIKey |
NJJHYZCOJKJHIY-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