General Information of the Compound
| Compound ID |
CP0571927
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| Compound Name |
1-(1H-imidazol-5-ylmethyl)-5-methyl-3-(2-phenylethyl)thieno[2,3-d]pyrimidine-2,4-dione
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| Structure |
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| Formula |
C19H18N4O2S
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| Molecular Weight |
366.446
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| Canonical SMILES |
Cc1csc2n(Cc3cnc[nH]3)c(=O)n(CCc3ccccc3)c(=O)c12
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| InChI |
InChI=1S/C19H18N4O2S/c1-13-11-26-18-16(13)17(24)22(8-7-14-5-3-2-4-6-14)19(25)23(18)10-15-9-20-12-21-15/h2-6,9,11-12H,7-8,10H2,1H3,(H,20,21)
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| InChIKey |
HDKVQZPVWAAQSA-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