General Information of the Compound
| Compound ID |
CP0499736
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| Compound Name |
4-[4-[9-(6-aminopyridin-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]-N-(1-methylpiperidin-4-yl)benzamide
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| Structure |
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| Formula |
C37H34N6O2
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| Molecular Weight |
594.719
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| Canonical SMILES |
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc(N)nc1
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| InChI |
InChI=1S/C37H34N6O2/c1-23-19-30(10-11-31(23)24-3-5-25(6-4-24)37(45)41-29-15-17-42(2)18-16-29)43-35(44)14-9-28-22-39-33-12-7-26(20-32(33)36(28)43)27-8-13-34(38)40-21-27/h3-14,19-22,29H,15-18H2,1-2H3,(H2,38,40)(H,41,45)
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| InChIKey |
DGZPYPBUJVSRMZ-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