General Information of the Compound
| Compound ID |
CP0409425
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| Compound Name |
1N-{2-(1H-3-indolyl)-1-[2-methoxybenzyl(methyl)carboxamidomethyl]ethyl}-2-(4-methoxyphenyl)acetamide
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| Structure |
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| Formula |
C30H33N3O4
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| Molecular Weight |
499.611
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| Canonical SMILES |
COc1ccc(CC(=O)NC(CN(Cc2ccccc2OC)C(C)=O)Cc2c[nH]c3ccccc23)cc1
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| InChI |
InChI=1S/C30H33N3O4/c1-21(34)33(19-23-8-4-7-11-29(23)37-3)20-25(17-24-18-31-28-10-6-5-9-27(24)28)32-30(35)16-22-12-14-26(36-2)15-13-22/h4-15,18,25,31H,16-17,19-20H2,1-3H3,(H,32,35)
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| InChIKey |
GKZHSLWHRYPKDP-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