General Information of the Compound
| Compound ID |
CP0435522
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| Compound Name |
2-(3-benzyl-3H-inden-1-yl)-N-methylethanamine
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| Synonyms |
CHEMBL194174
[2-(3-Benzyl-3H-inden-1-yl)-ethyl]-methyl-amine
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| Structure |
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| Formula |
C19H21N
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| Molecular Weight |
263.384
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| Canonical SMILES |
CNCCC1=CC(Cc2ccccc2)c2ccccc12
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| InChI |
InChI=1S/C19H21N/c1-20-12-11-16-14-17(13-15-7-3-2-4-8-15)19-10-6-5-9-18(16)19/h2-10,14,17,20H,11-13H2,1H3
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| InChIKey |
UHYPQIJLHJTNMK-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
Clinical Information about the Compound