General Information of the Compound
| Compound ID |
CP0877748
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| Compound Name |
4-(4-fluorophenyl)-2-(2-(1-phenylethylidene)hydrazinyl)thiazole
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| Structure |
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| Formula |
C17H14FN3S
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| Molecular Weight |
311.385
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| Canonical SMILES |
C/C(=N/Nc1nc(-c2ccc(F)cc2)cs1)c1ccccc1
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| InChI |
InChI=1S/C17H14FN3S/c1-12(13-5-3-2-4-6-13)20-21-17-19-16(11-22-17)14-7-9-15(18)10-8-14/h2-11H,1H3,(H,19,21)/b20-12-
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| InChIKey |
ZUEUWXSOMQQKIU-NDENLUEZSA-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