General Information of the Compound
| Compound ID |
CP0881690
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| Compound Name |
(E)-2-(3-ethyl-2-methyl-6,7-dihydro-1H-indol-4(5H)-ylidene)-N-(3-(trifluoromethyl)phenyl)hydrazinecarbothioamide
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| Structure |
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| Formula |
C19H21F3N4S
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| Molecular Weight |
394.466
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| Canonical SMILES |
CCc1c(C)[nH]c2c1/C(=N/NC(=S)Nc1cccc(C(F)(F)F)c1)CCC2
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| InChI |
InChI=1S/C19H21F3N4S/c1-3-14-11(2)23-15-8-5-9-16(17(14)15)25-26-18(27)24-13-7-4-6-12(10-13)19(20,21)22/h4,6-7,10,23H,3,5,8-9H2,1-2H3,(H2,24,26,27)/b25-16+
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| InChIKey |
JCUCSPHKZWJLFC-PCLIKHOPSA-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