General Information of the Compound
| Compound ID |
CP0935721
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| Compound Name |
(Z)-2-((E)-3-phenyl-1-p-tolylallylidene)hydrazinecarbothioamide
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| Structure |
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| Formula |
C17H17N3S
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| Molecular Weight |
295.411
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| Canonical SMILES |
Cc1ccc(C(/C=C/c2ccccc2)=N\NC(N)=S)cc1
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| InChI |
InChI=1S/C17H17N3S/c1-13-7-10-15(11-8-13)16(19-20-17(18)21)12-9-14-5-3-2-4-6-14/h2-12H,1H3,(H3,18,20,21)/b12-9+,19-16-
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| InChIKey |
VPKCMZUUHKVTQG-GMPOYPNHSA-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