General Information of the Compound
| Compound ID |
CP0512804
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| Compound Name |
8-[4-[4-(1H-indol-3-yl)butyl]piperazin-1-yl]-1,2,3,4-tetrahydroacridin-9-amine
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| Structure |
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| Formula |
C29H35N5
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| Molecular Weight |
453.634
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| Canonical SMILES |
Nc1c2CCCCc2nc2cccc(N3CCN(CCCCc4c[nH]c5ccccc45)CC3)c12
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| InChI |
InChI=1S/C29H35N5/c30-29-23-10-2-4-12-25(23)32-26-13-7-14-27(28(26)29)34-18-16-33(17-19-34)15-6-5-8-21-20-31-24-11-3-1-9-22(21)24/h1,3,7,9,11,13-14,20,31H,2,4-6,8,10,12,15-19H2,(H2,30,32)
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| InChIKey |
QJVGHNGLGSOMNC-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