General Information of the Compound
| Compound ID |
CP0083009
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| Compound Name |
1,1-diethyl-3-[3-[3-(imidazol-1-ylmethyl)phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylurea
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| Structure |
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| Formula |
C23H30N4O3S2
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| Molecular Weight |
474.652
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| Canonical SMILES |
CCN(CC)C(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1cccc(Cn2ccnc2)c1
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| InChI |
InChI=1S/C23H30N4O3S2/c1-5-27(6-2)23(28)25-32(29,30)22-21(14-20(31-22)12-17(3)4)19-9-7-8-18(13-19)15-26-11-10-24-16-26/h7-11,13-14,16-17H,5-6,12,15H2,1-4H3,(H,25,28)
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| InChIKey |
MPHWWISKKGXOSG-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