General Information of the Compound
| Compound ID |
CP0421100
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| Compound Name |
1-[3-(N-(1-acetylpiperidine-4-carbonyl)-3-chloroanilino)propyl]-N-benzyl-N-ethylpiperidine-4-carboxamide
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| Structure |
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| Formula |
C32H43ClN4O3
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| Molecular Weight |
567.174
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| Canonical SMILES |
CCN(Cc1ccccc1)C(=O)C1CCN(CCCN(C(=O)C2CCN(CC2)C(C)=O)c2cccc(Cl)c2)CC1
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| InChI |
InChI=1S/C32H43ClN4O3/c1-3-35(24-26-9-5-4-6-10-26)31(39)27-13-19-34(20-14-27)17-8-18-37(30-12-7-11-29(33)23-30)32(40)28-15-21-36(22-16-28)25(2)38/h4-7,9-12,23,27-28H,3,8,13-22,24H2,1-2H3
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| InChIKey |
HDYHDOVZUHZOKX-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