General Information of the Compound
| Compound ID |
CP0476547
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| Compound Name |
5-bromo-3-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]propyl]-1H-indole
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| Structure |
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| Formula |
C26H31BrN4
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| Molecular Weight |
479.466
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| Canonical SMILES |
Brc1ccc2[nH]cc(CCCN3CCN(CCCc4c[nH]c5ccccc45)CC3)c2c1
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| InChI |
InChI=1S/C26H31BrN4/c27-22-9-10-26-24(17-22)21(19-29-26)6-4-12-31-15-13-30(14-16-31)11-3-5-20-18-28-25-8-2-1-7-23(20)25/h1-2,7-10,17-19,28-29H,3-6,11-16H2
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| InChIKey |
LNEQBXLUJXRVGU-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