General Information of the Compound
| Compound ID |
CP0290551
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| Compound Name |
2-Piperidinoethyl 4-amino-5-chloro-2-methoxybenzoate
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| Synonyms |
148868-55-7
ML-10302
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| Structure |
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| Formula |
C15H21ClN2O3
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| Molecular Weight |
312.797
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| Canonical SMILES |
COc1cc(N)c(Cl)cc1C(=O)OCCN1CCCCC1
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| InChI |
InChI=1S/C15H21ClN2O3/c1-20-14-10-13(17)12(16)9-11(14)15(19)21-8-7-18-5-3-2-4-6-18/h9-10H,2-8,17H2,1H3
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| InChIKey |
RVFIAQAAZUEPPE-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: PT01307, 5-hydroxytryptamine receptor 4
Cell-based Assay
Clinical Information about the Compound