General Information of the Compound
| Compound ID |
CP0447704
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| Compound Name |
3-(1-octyl-5-m-tolyl-1H-indol-3-yl)propanamide
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| Structure |
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| Formula |
C26H34N2O
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| Molecular Weight |
390.571
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| Canonical SMILES |
CCCCCCCCn1cc(CCC(N)=O)c2cc(ccc12)-c1cccc(C)c1
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| InChI |
InChI=1S/C26H34N2O/c1-3-4-5-6-7-8-16-28-19-23(13-15-26(27)29)24-18-22(12-14-25(24)28)21-11-9-10-20(2)17-21/h9-12,14,17-19H,3-8,13,15-16H2,1-2H3,(H2,27,29)
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| InChIKey |
MPUVKNPIIVKSPU-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