General Information of the Compound
| Compound ID |
CP0220146
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| Compound Name |
N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]-2-(2-methoxyanilino)acetamide
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| Structure |
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| Formula |
C20H19N3O3
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| Molecular Weight |
349.39
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| Canonical SMILES |
COc1ccccc1NCC(=O)N\N=C\c1c(O)ccc2ccccc12
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| InChI |
InChI=1S/C20H19N3O3/c1-26-19-9-5-4-8-17(19)21-13-20(25)23-22-12-16-15-7-3-2-6-14(15)10-11-18(16)24/h2-12,21,24H,13H2,1H3,(H,23,25)/b22-12+
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| InChIKey |
UUSJWLDMBJMRQS-WSDLNYQXSA-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
Protein ID: PT06109, Geminin
Protein ID: PT01557, Indoleamine 2,3-dioxygenase 1
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic