General Information of the Compound
| Compound ID |
CP0472476
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| Compound Name |
1-ethyl-3-[(1-methyl-3,4-dihydro-2H-quinolin-2-yl)methyl]urea
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| Structure |
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| Formula |
C14H21N3O
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| Molecular Weight |
247.342
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| Canonical SMILES |
CCNC(=O)NCC1CCc2ccccc2N1C
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| InChI |
InChI=1S/C14H21N3O/c1-3-15-14(18)16-10-12-9-8-11-6-4-5-7-13(11)17(12)2/h4-7,12H,3,8-10H2,1-2H3,(H2,15,16,18)
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| InChIKey |
GROVGDFLIKUQFO-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