General Information of the Compound
| Compound ID |
CP0467160
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| Compound Name |
4-isobutyl-N-(2-(5-methoxy-1H-indol-3-yl)ethyl)benzamide
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| Structure |
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| Formula |
C22H26N2O2
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| Molecular Weight |
350.462
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| Canonical SMILES |
COc1ccc2[nH]cc(CCNC(=O)c3ccc(CC(C)C)cc3)c2c1
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| InChI |
InChI=1S/C22H26N2O2/c1-15(2)12-16-4-6-17(7-5-16)22(25)23-11-10-18-14-24-21-9-8-19(26-3)13-20(18)21/h4-9,13-15,24H,10-12H2,1-3H3,(H,23,25)
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| InChIKey |
VODAWNKTZVGHSA-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