General Information of the Compound
| Compound ID |
CP0455598
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| Compound Name |
trimethyl-[3-(2-oxo-4,4-diphenylimidazolidin-1-yl)propyl]azanium
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| Structure |
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| Formula |
C21H28N3O+
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| Molecular Weight |
338.475
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| Canonical SMILES |
C[N+](C)(C)CCCN1CC(NC1=O)(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C21H27N3O/c1-24(2,3)16-10-15-23-17-21(22-20(23)25,18-11-6-4-7-12-18)19-13-8-5-9-14-19/h4-9,11-14H,10,15-17H2,1-3H3/p+1
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| InChIKey |
CKBYLKDVYYBZOR-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