General Information of the Compound
| Compound ID |
CP0274826
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| Compound Name |
N-[2-(cyclohexylmethoxy)-4-nitrophenyl]-N-methylmethanesulfonamide
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| Structure |
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| Formula |
C15H22N2O5S
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| Molecular Weight |
342.417
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| Canonical SMILES |
CN(c1ccc(cc1OCC1CCCCC1)[N+]([O-])=O)S(C)(=O)=O
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| InChI |
InChI=1S/C15H22N2O5S/c1-16(23(2,20)21)14-9-8-13(17(18)19)10-15(14)22-11-12-6-4-3-5-7-12/h8-10,12H,3-7,11H2,1-2H3
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| InChIKey |
UAAAPHNKXUCAHZ-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