General Information of the Compound
| Compound ID |
CP0488678
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| Compound Name |
methyl 6-[4-(diaminomethylideneamino)benzoyl]oxynaphthalene-2-carboxylate
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| Structure |
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| Formula |
C20H17N3O4
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| Molecular Weight |
363.373
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| Canonical SMILES |
COC(=O)c1ccc2cc(OC(=O)c3ccc(NC(N)=N)cc3)ccc2c1
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| InChI |
InChI=1S/C20H17N3O4/c1-26-18(24)15-3-2-14-11-17(9-6-13(14)10-15)27-19(25)12-4-7-16(8-5-12)23-20(21)22/h2-11H,1H3,(H4,21,22,23)
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| InChIKey |
DVNNDDZBSYOOIJ-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