General Information of the Compound
| Compound ID |
CP0917196
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| Compound Name |
[5-Methyl-3-(2,4,6-trimethyl-phenyl)-1H-pyrazolo[4,3-d]pyrimidin-7-yl]-dipropyl-amine
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| Formula |
C21H29N5
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| Molecular Weight |
351.498
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| Canonical SMILES |
CCCN(CCC)c1[nH]c(C)nc2c(-c3c(C)cc(C)cc3C)nnc1-2
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| InChI |
InChI=1S/C21H29N5/c1-7-9-26(10-8-2)21-20-19(22-16(6)23-21)18(24-25-20)17-14(4)11-13(3)12-15(17)5/h11-12H,7-10H2,1-6H3,(H,22,23)
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| InChIKey |
YPOLAVSCFHPDKK-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