General Information of the Compound
| Compound ID |
CP0519874
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| Compound Name |
(1-octyl-5-m-tolyl-1H-indol-3-yl)methanamine
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| Structure |
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| Formula |
C24H32N2
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| Molecular Weight |
348.534
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| Canonical SMILES |
CCCCCCCCn1cc(CN)c2cc(ccc12)-c1cccc(C)c1
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| InChI |
InChI=1S/C24H32N2/c1-3-4-5-6-7-8-14-26-18-22(17-25)23-16-21(12-13-24(23)26)20-11-9-10-19(2)15-20/h9-13,15-16,18H,3-8,14,17,25H2,1-2H3
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| InChIKey |
KXEPCPZIVJDTOI-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