General Information of the Compound
| Compound ID |
CP0957763
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| Compound Name |
4-((2-(4,6-dimorpholino-1,3,5-triazin-2-yl)hydrazono)methyl)benzene-1,3-diol
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| Structure |
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| Formula |
C18H23N7O4
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| Molecular Weight |
401.427
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| Canonical SMILES |
Oc1ccc(/C=N/Nc2nc(N3CCOCC3)nc(N3CCOCC3)n2)c(O)c1
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| InChI |
InChI=1S/C18H23N7O4/c26-14-2-1-13(15(27)11-14)12-19-23-16-20-17(24-3-7-28-8-4-24)22-18(21-16)25-5-9-29-10-6-25/h1-2,11-12,26-27H,3-10H2,(H,20,21,22,23)/b19-12+
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| InChIKey |
VMUCPXGATJAKRE-XDHOZWIPSA-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