General Information of the Compound
| Compound ID |
CP0311155
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| Compound Name |
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbutan-1-amine
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| Structure |
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| Formula |
C21H26N2O
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| Molecular Weight |
322.452
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| Canonical SMILES |
COc1ccc2[nH]cc(CCNCCCCc3ccccc3)c2c1
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| InChI |
InChI=1S/C21H26N2O/c1-24-19-10-11-21-20(15-19)18(16-23-21)12-14-22-13-6-5-9-17-7-3-2-4-8-17/h2-4,7-8,10-11,15-16,22-23H,5-6,9,12-14H2,1H3
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| InChIKey |
KFIJSLAJJSSAOJ-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