General Information of the Compound
| Compound ID |
CP0563402
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| Compound Name |
1-[(3,7-dimethyl-1-tricyclo[3.3.0.03,7]octanyl)methyl]-3-(2,3,4-trifluorophenyl)urea
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| Structure |
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| Formula |
C18H21F3N2O
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| Molecular Weight |
338.373
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| Canonical SMILES |
CC12CC3CC1(C)CC3(CNC(=O)Nc1ccc(F)c(F)c1F)C2
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| InChI |
InChI=1S/C18H21F3N2O/c1-16-5-10-6-17(16,2)8-18(10,7-16)9-22-15(24)23-12-4-3-11(19)13(20)14(12)21/h3-4,10H,5-9H2,1-2H3,(H2,22,23,24)
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| InChIKey |
ALBGJFOYVAXDGV-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