General Information of the Compound
| Compound ID |
CP0939808
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| Compound Name |
(Z)-2-((E)-1-(4-bromophenyl)-3-(4-fluorophenyl)allylidene)hydrazinecarbothioamide
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| Structure |
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| Formula |
C16H13BrFN3S
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| Molecular Weight |
378.27
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| Canonical SMILES |
NC(=S)N/N=C(/C=C/c1ccc(F)cc1)c1ccc(Br)cc1
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| InChI |
InChI=1S/C16H13BrFN3S/c17-13-6-4-12(5-7-13)15(20-21-16(19)22)10-3-11-1-8-14(18)9-2-11/h1-10H,(H3,19,21,22)/b10-3+,20-15-
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| InChIKey |
HVVSAIWFDYFCSC-KOGLFJQZSA-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