General Information of the Compound
| Compound ID |
CP0548435
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| Compound Name |
4-chloro-N-[2-(4-methylpiperazin-1-yl)ethyl]benzamide
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| Structure |
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| Formula |
C14H20ClN3O
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| Molecular Weight |
281.787
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| Canonical SMILES |
CN1CCN(CCNC(=O)c2ccc(Cl)cc2)CC1
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| InChI |
InChI=1S/C14H20ClN3O/c1-17-8-10-18(11-9-17)7-6-16-14(19)12-2-4-13(15)5-3-12/h2-5H,6-11H2,1H3,(H,16,19)
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| InChIKey |
KGRWNLAIDPQUHR-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: PT03632, Sigma intracellular receptor 2
Protein ID: PT01509, Sigma non-opioid intracellular receptor 1