General Information of the Compound
| Compound ID |
CP0510342
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| Compound Name |
(3E)-3-[[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]hydrazinylidene]inden-1-one
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| Structure |
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| Formula |
C19H15N3O2S
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| Molecular Weight |
349.415
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| Canonical SMILES |
COc1cccc(c1)-c1csc(N\N=C2/CC(=O)c3ccccc23)n1
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| InChI |
InChI=1S/C19H15N3O2S/c1-24-13-6-4-5-12(9-13)17-11-25-19(20-17)22-21-16-10-18(23)15-8-3-2-7-14(15)16/h2-9,11H,10H2,1H3,(H,20,22)/b21-16+
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| InChIKey |
LJLXZXRTUYTZIS-LTGZKZEYSA-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