General Information of the Compound
| Compound ID |
CP0536172
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| Compound Name |
1-[4-(4-cyclohexylpiperazin-1-yl)butyl]indole
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| Structure |
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| Formula |
C22H33N3
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| Molecular Weight |
339.527
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| Canonical SMILES |
C(CCn1ccc2ccccc12)CN1CCN(CC1)C1CCCCC1
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| InChI |
InChI=1S/C22H33N3/c1-2-9-21(10-3-1)24-18-16-23(17-19-24)13-6-7-14-25-15-12-20-8-4-5-11-22(20)25/h4-5,8,11-12,15,21H,1-3,6-7,9-10,13-14,16-19H2
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| InChIKey |
QTVZKXTYXRRYBK-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