General Information of the Compound
| Compound ID |
CP0372093
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| Compound Name |
5-cyano-N-(4-(4-methylpiperazin-1-yl)-2-morpholinophenyl)furan-2-carboxamide
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| Structure |
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| Formula |
C21H25N5O3
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| Molecular Weight |
395.463
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| Canonical SMILES |
CN1CCN(CC1)c1ccc(NC(=O)c2ccc(o2)C#N)c(c1)N1CCOCC1
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| InChI |
InChI=1S/C21H25N5O3/c1-24-6-8-25(9-7-24)16-2-4-18(19(14-16)26-10-12-28-13-11-26)23-21(27)20-5-3-17(15-22)29-20/h2-5,14H,6-13H2,1H3,(H,23,27)
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| InChIKey |
VTZUDEVOBJHTGP-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