General Information of the Compound
| Compound ID |
CP0419996
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| Compound Name |
N-[(2-methoxyphenyl)methyl]-2-[(7-phenyl-1H-indol-3-yl)sulfanyl]acetamide
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| Formula |
C24H22N2O2S
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| Molecular Weight |
402.519
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| Canonical SMILES |
COc1ccccc1CNC(=O)CSc1c[nH]c2c(cccc12)-c1ccccc1
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| InChI |
InChI=1S/C24H22N2O2S/c1-28-21-13-6-5-10-18(21)14-25-23(27)16-29-22-15-26-24-19(11-7-12-20(22)24)17-8-3-2-4-9-17/h2-13,15,26H,14,16H2,1H3,(H,25,27)
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| InChIKey |
BJJVJYHBCURDRW-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