General Information of the Compound
| Compound ID |
CP0474429
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| Compound Name |
4-((1-octyl-5-m-tolyl-1H-indol-3-yl)methyl)morpholine
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| Structure |
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| Formula |
C28H38N2O
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| Molecular Weight |
418.625
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| Canonical SMILES |
CCCCCCCCn1cc(CN2CCOCC2)c2cc(ccc12)-c1cccc(C)c1
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| InChI |
InChI=1S/C28H38N2O/c1-3-4-5-6-7-8-14-30-22-26(21-29-15-17-31-18-16-29)27-20-25(12-13-28(27)30)24-11-9-10-23(2)19-24/h9-13,19-20,22H,3-8,14-18,21H2,1-2H3
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| InChIKey |
WBYNRAKSMBJLNM-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