General Information of the Compound
| Compound ID |
CP0416769
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| Compound Name |
1-N,3-N-bis(2-piperidin-1-ylethyl)-5-[2-(piperidin-1-ylmethyl)anilino]benzene-1,3-dicarboxamide
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| Structure |
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| Formula |
C34H50N6O2
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| Molecular Weight |
574.814
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| Canonical SMILES |
O=C(NCCN1CCCCC1)c1cc(Nc2ccccc2CN2CCCCC2)cc(c1)C(=O)NCCN1CCCCC1
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| InChI |
InChI=1S/C34H50N6O2/c41-33(35-14-22-38-16-6-1-7-17-38)29-24-30(34(42)36-15-23-39-18-8-2-9-19-39)26-31(25-29)37-32-13-5-4-12-28(32)27-40-20-10-3-11-21-40/h4-5,12-13,24-26,37H,1-3,6-11,14-23,27H2,(H,35,41)(H,36,42)
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| InChIKey |
JDNDSLUKZJXACE-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