General Information of the Compound
| Compound ID |
CP0493366
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| Compound Name |
6-benzyl-3-[3-(pyridin-2-ylmethoxy)phenyl]-1,4-dihydropyrido[4,3-d]pyrimidine-2,7-dione
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| Structure |
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| Formula |
C26H22N4O3
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| Molecular Weight |
438.487
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| Canonical SMILES |
O=C1Nc2cc(=O)n(Cc3ccccc3)cc2CN1c1cccc(OCc2ccccn2)c1
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| InChI |
InChI=1S/C26H22N4O3/c31-25-14-24-20(16-29(25)15-19-7-2-1-3-8-19)17-30(26(32)28-24)22-10-6-11-23(13-22)33-18-21-9-4-5-12-27-21/h1-14,16H,15,17-18H2,(H,28,32)
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| InChIKey |
NZYWZQVSAMCCCA-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