General Information of the Compound
| Compound ID |
CP0322877
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| Compound Name |
[4-(1,3-benzodioxol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)-1H-imidazol-2-yl]methanamine
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| Structure |
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| Formula |
C15H14N4O2S
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| Molecular Weight |
314.37
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| Canonical SMILES |
Cc1csc(n1)-c1[nH]c(CN)nc1-c1ccc2OCOc2c1
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| InChI |
InChI=1S/C15H14N4O2S/c1-8-6-22-15(17-8)14-13(18-12(5-16)19-14)9-2-3-10-11(4-9)21-7-20-10/h2-4,6H,5,7,16H2,1H3,(H,18,19)
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| InChIKey |
MBTAXWYDKFCVAW-UHFFFAOYSA-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