General Information of the Compound
| Compound ID |
CP0388713
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| Compound Name |
N-[2,4-dimethyl-5-(4-methyl-1,3-thiazol-2-yl)phenyl]-4-(pyridin-2-ylmethoxy)benzamide
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| Structure |
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| Formula |
C25H23N3O2S
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| Molecular Weight |
429.545
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| Canonical SMILES |
Cc1csc(n1)-c1cc(NC(=O)c2ccc(OCc3ccccn3)cc2)c(C)cc1C
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| InChI |
InChI=1S/C25H23N3O2S/c1-16-12-17(2)23(13-22(16)25-27-18(3)15-31-25)28-24(29)19-7-9-21(10-8-19)30-14-20-6-4-5-11-26-20/h4-13,15H,14H2,1-3H3,(H,28,29)
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| InChIKey |
JRSCPBAQPXXZTE-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