General Information of the Compound
| Compound ID |
CP0564597
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| Compound Name |
6-[3-oxo-3-[2-(4-propan-2-yloxyanilino)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]propyl]-3H-1,3-benzoxazol-2-one
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| Structure |
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| Formula |
C26H27N5O4
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| Molecular Weight |
473.533
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| Canonical SMILES |
CC(C)Oc1ccc(Nc2ncc3CN(CCc3n2)C(=O)CCc2ccc3[nH]c(=O)oc3c2)cc1
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| InChI |
InChI=1S/C26H27N5O4/c1-16(2)34-20-7-5-19(6-8-20)28-25-27-14-18-15-31(12-11-21(18)29-25)24(32)10-4-17-3-9-22-23(13-17)35-26(33)30-22/h3,5-9,13-14,16H,4,10-12,15H2,1-2H3,(H,30,33)(H,27,28,29)
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| InChIKey |
GFOXRASESXUIGY-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