General Information of the Compound
| Compound ID |
CP0540297
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| Compound Name |
N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]-1-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]piperidine-4-carboxamide
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| Structure |
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| Formula |
C29H50N4O5
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| Molecular Weight |
534.742
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| Canonical SMILES |
NCCOCCOCCOCCNC(=O)C1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
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| InChI |
InChI=1S/C29H50N4O5/c30-11-19-35-21-23-37-24-22-36-20-12-31-29(34)27-9-16-33(17-10-27)25-26-5-7-28(8-6-26)38-18-4-15-32-13-2-1-3-14-32/h5-8,27H,1-4,9-25,30H2,(H,31,34)
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| InChIKey |
XKXYQFPOJJXYNK-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