General Information of the Compound
| Compound ID |
CP0437696
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| Compound Name |
2-(furan-2-yl)-N7-(2-(4-(4-(2-methoxyethoxy)phenyl)piperazin-1-yl)ethyl)-[1,2,4]triazolo[1,5-c]pyrimidine-5,7-diamine
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| Structure |
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| Formula |
C24H30N8O3
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| Molecular Weight |
478.557
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| Canonical SMILES |
COCCOc1ccc(cc1)N1CCN(CCNc2cc3nc(nn3c(N)n2)-c2ccco2)CC1
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| InChI |
InChI=1S/C24H30N8O3/c1-33-15-16-34-19-6-4-18(5-7-19)31-12-10-30(11-13-31)9-8-26-21-17-22-28-23(20-3-2-14-35-20)29-32(22)24(25)27-21/h2-7,14,17,26H,8-13,15-16H2,1H3,(H2,25,27)
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| InChIKey |
KQDOPPPFRYWNIG-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