General Information of the Compound
| Compound ID |
CP0917452
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| Compound Name |
1-((1H-indol-3-yl)methylene)-2-(4-(2,4-difluorophenyl)thiazol-2-yl)hydrazine
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| Structure |
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| Formula |
C18H12F2N4S
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| Molecular Weight |
354.385
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| Canonical SMILES |
Fc1ccc(-c2csc(N/N=C\c3c[nH]c4ccccc34)n2)c(F)c1
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| InChI |
InChI=1S/C18H12F2N4S/c19-12-5-6-14(15(20)7-12)17-10-25-18(23-17)24-22-9-11-8-21-16-4-2-1-3-13(11)16/h1-10,21H,(H,23,24)/b22-9-
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| InChIKey |
WBPPYDHHLBAYPQ-AFPJDJCSSA-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