General Information of the Compound
| Compound ID |
CP0947091
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| Compound Name |
(E/Z)-1-(5-Methyl-4-phenylthiazol-2-yl)-2-(4-methylpentan-2-ylidene)-hydrazine
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| Structure |
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| Formula |
C16H21N3S
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| Molecular Weight |
287.432
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| Canonical SMILES |
C/C(CC(C)C)=N/Nc1nc(-c2ccccc2)c(C)s1
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| InChI |
InChI=1S/C16H21N3S/c1-11(2)10-12(3)18-19-16-17-15(13(4)20-16)14-8-6-5-7-9-14/h5-9,11H,10H2,1-4H3,(H,17,19)/b18-12-
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| InChIKey |
IIVQFEVCVWTJTD-PDGQHHTCSA-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