General Information of the Compound
| Compound ID |
CP0950665
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| Compound Name |
Benzyltriethyl-ammonium
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| Structure |
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| Formula |
C13H22N+
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| Molecular Weight |
192.326
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| Canonical SMILES |
CC[N+](CC)(CC)Cc1ccccc1
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| InChI |
InChI=1S/C13H22N/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13/h7-11H,4-6,12H2,1-3H3/q+1
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| InChIKey |
VBQDSLGFSUGBBE-UHFFFAOYSA-N
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| CAS |
16652-03-2
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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