General Information of the Compound
| Compound ID |
CP0505963
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| Compound Name |
N-[[5-(3-methylphenyl)-1-octylindol-3-yl]methyl]-N-propylpropan-1-amine
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| Structure |
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| Formula |
C30H44N2
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| Molecular Weight |
432.696
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| Canonical SMILES |
CCCCCCCCn1cc(CN(CCC)CCC)c2cc(ccc12)-c1cccc(C)c1
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| InChI |
InChI=1S/C30H44N2/c1-5-8-9-10-11-12-20-32-24-28(23-31(18-6-2)19-7-3)29-22-27(16-17-30(29)32)26-15-13-14-25(4)21-26/h13-17,21-22,24H,5-12,18-20,23H2,1-4H3
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| InChIKey |
PYRKQGOMDGYGRH-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