General Information of the Compound
| Compound ID |
CP0309262
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| Compound Name |
N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]hexanamide
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| Structure |
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| Formula |
C18H28ClN3O
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| Molecular Weight |
337.895
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| Canonical SMILES |
CCCCCC(=O)Nc1ccc(N2CCN(CC)CC2)c(Cl)c1
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| InChI |
InChI=1S/C18H28ClN3O/c1-3-5-6-7-18(23)20-15-8-9-17(16(19)14-15)22-12-10-21(4-2)11-13-22/h8-9,14H,3-7,10-13H2,1-2H3,(H,20,23)
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| InChIKey |
YYYAVCKEQQNXIB-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
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT01913, Muscarinic acetylcholine receptor M1
Protein ID: PT01736, Muscarinic acetylcholine receptor M4