General Information of the Compound
| Compound ID |
CP0455506
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| Compound Name |
5-N-(2-chloro-4-methoxyphenyl)-5-N-(2-methylprop-2-enyl)-7-N,7-N-dipropylpyrazolo[1,5-a]pyrimidine-5,7-diamine
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| Structure |
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| Formula |
C23H30ClN5O
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| Molecular Weight |
427.98
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| Canonical SMILES |
CCCN(CCC)c1cc(nc2ccnn12)N(CC(C)=C)c1ccc(OC)cc1Cl
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| InChI |
InChI=1S/C23H30ClN5O/c1-6-12-27(13-7-2)23-15-22(26-21-10-11-25-29(21)23)28(16-17(3)4)20-9-8-18(30-5)14-19(20)24/h8-11,14-15H,3,6-7,12-13,16H2,1-2,4-5H3
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| InChIKey |
OFIASSLJWCJYNI-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