General Information of the Compound
| Compound ID |
CP0673870
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| Compound Name |
2-(6-{[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl](methyl)amino}-2,3-dihydro-1H-inden-1-ylidene)hydrazinecarboximidamide hydrochloride
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| Structure |
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| Formula |
C16H17Cl2N7O2S2
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| Molecular Weight |
474.399
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| Canonical SMILES |
CN(c1ccc2c(c1)/C(=N/NC(=N)N)CC2)S(=O)(=O)c1c(Cl)nc2sccn12.Cl
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| InChI |
InChI=1S/C16H16ClN7O2S2.ClH/c1-23(28(25,26)14-13(17)20-16-24(14)6-7-27-16)10-4-2-9-3-5-12(11(9)8-10)21-22-15(18)19;/h2,4,6-8H,3,5H2,1H3,(H4,18,19,22);1H/b21-12+;
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| InChIKey |
DOGRJCWJIDMQQB-BFVDCFMLSA-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