General Information of the Compound
| Compound ID |
CP0486651
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| Compound Name |
N'-[2,5-dimethyl-3-(2,4,6-trimethylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-[2-(4-methoxyphenyl)ethyl]ethane-1,2-diamine
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| Structure |
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| Formula |
C28H35N5O
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| Molecular Weight |
457.622
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| Canonical SMILES |
COc1ccc(CCNCCNc2cc(C)nc3c(c(C)nn23)-c2c(C)cc(C)cc2C)cc1
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| InChI |
InChI=1S/C28H35N5O/c1-18-15-19(2)26(20(3)16-18)27-22(5)32-33-25(17-21(4)31-28(27)33)30-14-13-29-12-11-23-7-9-24(34-6)10-8-23/h7-10,15-17,29-30H,11-14H2,1-6H3
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| InChIKey |
QJJMKLJWZWFUNB-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