General Information of the Compound
| Compound ID |
CP0527025
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| Compound Name |
N-[2-[3-(4-methoxyphenyl)-7-[(3-methylphenyl)methylamino]-2-oxoquinoxalin-1-yl]ethyl]acetamide
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| Structure |
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| Formula |
C27H28N4O3
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| Molecular Weight |
456.546
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| Canonical SMILES |
COc1ccc(cc1)-c1nc2ccc(NCc3cccc(C)c3)cc2n(CCNC(C)=O)c1=O
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| InChI |
InChI=1S/C27H28N4O3/c1-18-5-4-6-20(15-18)17-29-22-9-12-24-25(16-22)31(14-13-28-19(2)32)27(33)26(30-24)21-7-10-23(34-3)11-8-21/h4-12,15-16,29H,13-14,17H2,1-3H3,(H,28,32)
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| InChIKey |
ZVDNSERVQXIYPJ-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