General Information of the Compound
| Compound ID |
CP0487763
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| Compound Name |
6-benzyl-3-[2-(3-fluoropyridin-2-yl)-6-methyl-3,4-dihydro-2H-chromen-7-yl]-1-methyl-4H-pyrido[4,3-d]pyrimidine-2,7-dione
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| Structure |
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| Formula |
C30H27FN4O3
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| Molecular Weight |
510.569
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| Canonical SMILES |
CN1C(=O)N(Cc2cn(Cc3ccccc3)c(=O)cc12)c1cc2OC(CCc2cc1C)c1ncccc1F
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| InChI |
InChI=1S/C30H27FN4O3/c1-19-13-21-10-11-26(29-23(31)9-6-12-32-29)38-27(21)14-24(19)35-18-22-17-34(16-20-7-4-3-5-8-20)28(36)15-25(22)33(2)30(35)37/h3-9,12-15,17,26H,10-11,16,18H2,1-2H3
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| InChIKey |
FMFDDHKGNCBMGG-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