General Information of the Compound
| Compound ID |
CP0867453
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| Compound Name |
2-(2-(3-methylcyclohexylidene)hydrazinyl)-4-phenylthiazole
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| Structure |
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| Formula |
C16H19N3S
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| Molecular Weight |
285.416
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| Canonical SMILES |
CC1CCC/C(=N/Nc2nc(-c3ccccc3)cs2)C1
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| InChI |
InChI=1S/C16H19N3S/c1-12-6-5-9-14(10-12)18-19-16-17-15(11-20-16)13-7-3-2-4-8-13/h2-4,7-8,11-12H,5-6,9-10H2,1H3,(H,17,19)/b18-14-
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| InChIKey |
TYXGDELQOONTQQ-JXAWBTAJSA-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