General Information of the Compound
| Compound ID |
CP0370316
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| Compound Name |
N-[2-[4-(2-hydroxyethyl)piperidin-1-yl]phenyl]-5-nitrofuran-2-carboxamide
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| Structure |
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| Formula |
C18H21N3O5
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| Molecular Weight |
359.382
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| Canonical SMILES |
OCCC1CCN(CC1)c1ccccc1NC(=O)c1ccc(o1)[N+]([O-])=O
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| InChI |
InChI=1S/C18H21N3O5/c22-12-9-13-7-10-20(11-8-13)15-4-2-1-3-14(15)19-18(23)16-5-6-17(26-16)21(24)25/h1-6,13,22H,7-12H2,(H,19,23)
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| InChIKey |
STKYHMXEZBWKKZ-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