General Information of the Compound
| Compound ID |
CP0484500
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| Compound Name |
3-[3-[4-[3-(1H-indol-3-yl)propyl]piperazin-1-yl]propyl]-5-methoxy-1H-indole
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| Structure |
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| Formula |
C27H34N4O
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| Molecular Weight |
430.596
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| Canonical SMILES |
COc1ccc2[nH]cc(CCCN3CCN(CCCc4c[nH]c5ccccc45)CC3)c2c1
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| InChI |
InChI=1S/C27H34N4O/c1-32-23-10-11-27-25(18-23)22(20-29-27)7-5-13-31-16-14-30(15-17-31)12-4-6-21-19-28-26-9-3-2-8-24(21)26/h2-3,8-11,18-20,28-29H,4-7,12-17H2,1H3
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| InChIKey |
VYIPGOSBTWWNBJ-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