General Information of the Compound
| Compound ID |
CP0262586
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| Compound Name |
[2-[(4-hydroxy-3-methoxyphenyl)methylamino]-2-oxoethyl] dodecanoate
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| Structure |
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| Formula |
C22H35NO5
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| Molecular Weight |
393.524
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| Canonical SMILES |
CCCCCCCCCCCC(=O)OCC(=O)NCc1ccc(O)c(OC)c1
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| InChI |
InChI=1S/C22H35NO5/c1-3-4-5-6-7-8-9-10-11-12-22(26)28-17-21(25)23-16-18-13-14-19(24)20(15-18)27-2/h13-15,24H,3-12,16-17H2,1-2H3,(H,23,25)
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| InChIKey |
XJQPEXQHOOCRNS-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
Protein ID: PT01914, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1