General Information of the Compound
| Compound ID |
CP0425754
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| Compound Name |
2-(5-(3-ethoxyphenyl)-1-octyl-1H-indol-3-yl)-N,N-diethylacetamide
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| Structure |
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| Formula |
C30H42N2O2
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| Molecular Weight |
462.678
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| Canonical SMILES |
CCCCCCCCn1cc(CC(=O)N(CC)CC)c2cc(ccc12)-c1cccc(OCC)c1
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| InChI |
InChI=1S/C30H42N2O2/c1-5-9-10-11-12-13-19-32-23-26(22-30(33)31(6-2)7-3)28-21-25(17-18-29(28)32)24-15-14-16-27(20-24)34-8-4/h14-18,20-21,23H,5-13,19,22H2,1-4H3
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| InChIKey |
FTIIQXUEAVOIDW-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