General Information of the Compound
| Compound ID |
CP0530831
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| Compound Name |
1,5-dimethyl-6-[2-methyl-4-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)oxy]phenyl]pyrimidine-2,4-dione
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| Structure |
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| Formula |
C21H22N4O3
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| Molecular Weight |
378.432
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| Canonical SMILES |
Cc1nc2CCCc2c(Oc2ccc(c(C)c2)-c2c(C)c(=O)[nH]c(=O)n2C)n1
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| InChI |
InChI=1S/C21H22N4O3/c1-11-10-14(28-20-16-6-5-7-17(16)22-13(3)23-20)8-9-15(11)18-12(2)19(26)24-21(27)25(18)4/h8-10H,5-7H2,1-4H3,(H,24,26,27)
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| InChIKey |
TYSYVCSUIHXYHZ-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