General Information of the Compound
| Compound ID |
CP0866576
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| Compound Name |
(E/Z)-1-(3-Methylcyclohexylidene)-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 |
CC1CCC/C(=N\Nc2nc(-c3ccc4ccccc4c3)cs2)C1
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| InChI |
InChI=1S/C20H21N3S/c1-14-5-4-8-18(11-14)22-23-20-21-19(13-24-20)17-10-9-15-6-2-3-7-16(15)12-17/h2-3,6-7,9-10,12-14H,4-5,8,11H2,1H3,(H,21,23)/b22-18+
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| InChIKey |
AKEKBTVCXFJYHR-RELWKKBWSA-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