General Information of the Compound
| Compound ID |
CP0523062
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| Compound Name |
benzyl 1-acetyl-2-benzyl-3H-indole-2-carboxylate
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| Structure |
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| Formula |
C25H23NO3
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| Molecular Weight |
385.463
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| Canonical SMILES |
CC(=O)N1c2ccccc2CC1(Cc1ccccc1)C(=O)OCc1ccccc1
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| InChI |
InChI=1S/C25H23NO3/c1-19(27)26-23-15-9-8-14-22(23)17-25(26,16-20-10-4-2-5-11-20)24(28)29-18-21-12-6-3-7-13-21/h2-15H,16-18H2,1H3
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| InChIKey |
NGCUUQPCZYTOLO-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