General Information of the Compound
| Compound ID |
CP0492357
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| Compound Name |
N-[3-(3,4-dimethylphenyl)propyl]-2-(4-hydroxy-3-methoxyphenyl)acetamide
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| Structure |
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| Formula |
C20H25NO3
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| Molecular Weight |
327.424
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| Canonical SMILES |
COc1cc(CC(=O)NCCCc2ccc(C)c(C)c2)ccc1O
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| InChI |
InChI=1S/C20H25NO3/c1-14-6-7-16(11-15(14)2)5-4-10-21-20(23)13-17-8-9-18(22)19(12-17)24-3/h6-9,11-12,22H,4-5,10,13H2,1-3H3,(H,21,23)
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| InChIKey |
QKPILXKEMJWKBI-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