General Information of the Compound
| Compound ID |
CP0859514
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| Compound Name |
(E/Z)-4-(naphthalen-2-yl)-2-(2-(1-phenylethylidene)hydrazinyl)thiazole
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| Structure |
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| Formula |
C21H17N3S
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| Molecular Weight |
343.455
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| Canonical SMILES |
C/C(=N\Nc1nc(-c2ccc3ccccc3c2)cs1)c1ccccc1
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| InChI |
InChI=1S/C21H17N3S/c1-15(16-7-3-2-4-8-16)23-24-21-22-20(14-25-21)19-12-11-17-9-5-6-10-18(17)13-19/h2-14H,1H3,(H,22,24)/b23-15+
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| InChIKey |
JQUWWCHJKXMEPD-HZHRSRAPSA-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: PT00918, Amine oxidase [flavin-containing] A
Protein ID: PT01362, Amine oxidase [flavin-containing] B