General Information of the Compound
| Compound ID |
CP0859625
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| Compound Name |
[amino({2-[(1Z)-4-{[4-(ethoxycarbonyl)phenyl]amino}-2-oxo-1,2-dihydronaphthalen-1-ylidene]hydrazin-1-yl})methylidene]azanium
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| Formula |
C20H19N5O3
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| Molecular Weight |
377.404
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| Canonical SMILES |
CCOC(=O)c1ccc(NC2=CC(=O)/C(=N\NC(=N)N)c3ccccc32)cc1
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| InChI |
InChI=1S/C20H19N5O3/c1-2-28-19(27)12-7-9-13(10-8-12)23-16-11-17(26)18(24-25-20(21)22)15-6-4-3-5-14(15)16/h3-11,23H,2H2,1H3,(H4,21,22,25)/b24-18-
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| InChIKey |
TYPBWLKJWGOCHV-MOHJPFBDSA-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