General Information of the Compound
| Compound ID |
CP0845590
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| Compound Name |
1-(4-(4-methoxyphenyl)thiazol-2-yl)-2-(2-methylcyclohexylidene)hydrazine
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| Structure |
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| Formula |
C17H21N3OS
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| Molecular Weight |
315.442
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| Canonical SMILES |
COc1ccc(-c2csc(N/N=C3\CCCCC3C)n2)cc1
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| InChI |
InChI=1S/C17H21N3OS/c1-12-5-3-4-6-15(12)19-20-17-18-16(11-22-17)13-7-9-14(21-2)10-8-13/h7-12H,3-6H2,1-2H3,(H,18,20)/b19-15+
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| InChIKey |
DKRVVZCXRBUGBO-XDJHFCHBSA-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