General Information of the Compound
| Compound ID |
CP0485324
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| Compound Name |
1-(4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl)-2-phenylethanone
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| Structure |
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| Formula |
C20H22N4OS
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| Molecular Weight |
366.49
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| Canonical SMILES |
CCc1cc2c(ncnc2s1)N1CCN(CC1)C(=O)Cc1ccccc1
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| InChI |
InChI=1S/C20H22N4OS/c1-2-16-13-17-19(21-14-22-20(17)26-16)24-10-8-23(9-11-24)18(25)12-15-6-4-3-5-7-15/h3-7,13-14H,2,8-12H2,1H3
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| InChIKey |
PSMGYCPOASWFCF-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