General Information of the Compound
| Compound ID |
CP0513340
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| Compound Name |
N,N-dibenzyl-2-(1-methylindol-3-yl)ethanamine
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| Structure |
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| Formula |
C25H26N2
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| Molecular Weight |
354.497
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| Canonical SMILES |
Cn1cc(CCN(Cc2ccccc2)Cc2ccccc2)c2ccccc12
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| InChI |
InChI=1S/C25H26N2/c1-26-20-23(24-14-8-9-15-25(24)26)16-17-27(18-21-10-4-2-5-11-21)19-22-12-6-3-7-13-22/h2-15,20H,16-19H2,1H3
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| InChIKey |
LRHCLVBJKHJVFW-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