General Information of the Compound
| Compound ID |
CP0968497
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| Compound Name |
2-[(2S)-4-benzylmorpholin-2-yl]-N-methyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]acetamide
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| Formula |
C19H27N4O2+
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| Molecular Weight |
343.451
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| Canonical SMILES |
CN(Cc1[nH]cc[n+]1C)C(=O)C[C@H]1CN(Cc2ccccc2)CCO1
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| InChI |
InChI=1S/C19H26N4O2/c1-21-9-8-20-18(21)15-22(2)19(24)12-17-14-23(10-11-25-17)13-16-6-4-3-5-7-16/h3-9,17H,10-15H2,1-2H3/p+1/t17-/m0/s1
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| InChIKey |
CMWABCKNZSLBAU-KRWDZBQOSA-O
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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