General Information of the Compound
| Compound ID |
CP0579244
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| Compound Name |
methyl N-[[4-[4-[(2-cyclopropylimidazol-1-yl)methyl]phenyl]-2-propyl-1,3-thiazol-5-yl]sulfonyl]carbamate
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| Structure |
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| Formula |
C21H24N4O4S2
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| Molecular Weight |
460.581
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| Canonical SMILES |
CCCc1nc(c(s1)S(=O)(=O)NC(=O)OC)-c1ccc(Cn2ccnc2C2CC2)cc1
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| InChI |
InChI=1S/C21H24N4O4S2/c1-3-4-17-23-18(20(30-17)31(27,28)24-21(26)29-2)15-7-5-14(6-8-15)13-25-12-11-22-19(25)16-9-10-16/h5-8,11-12,16H,3-4,9-10,13H2,1-2H3,(H,24,26)
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| InChIKey |
PEVAZODZBGMVOC-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