General Information of the Compound
| Compound ID |
CP0908144
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| Compound Name |
1-Cycloheptylidene-2-(4-(naphthalen-2-yl)thiazol-2-yl)hydrazine
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| Structure |
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| Formula |
C20H21N3S
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| Molecular Weight |
335.476
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| Canonical SMILES |
c1ccc2cc(-c3csc(NN=C4CCCCCC4)n3)ccc2c1
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| InChI |
InChI=1S/C20H21N3S/c1-2-4-10-18(9-3-1)22-23-20-21-19(14-24-20)17-12-11-15-7-5-6-8-16(15)13-17/h5-8,11-14H,1-4,9-10H2,(H,21,23)
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| InChIKey |
JHDIVSCVIHHGQB-UHFFFAOYSA-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