General Information of the Compound
| Compound ID |
CP0446158
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| Compound Name |
benzyl-dimethyl-[2-(2-oxo-4,4-diphenylimidazolidin-1-yl)ethyl]azanium
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| Structure |
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| Formula |
C26H30N3O+
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| Molecular Weight |
400.546
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| Canonical SMILES |
C[N+](C)(CCN1CC(NC1=O)(c1ccccc1)c1ccccc1)Cc1ccccc1
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| InChI |
InChI=1S/C26H29N3O/c1-29(2,20-22-12-6-3-7-13-22)19-18-28-21-26(27-25(28)30,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-17H,18-21H2,1-2H3/p+1
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| InChIKey |
POYPWMLCUXGEFJ-UHFFFAOYSA-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