General Information of the Compound
| Compound ID |
CP0550746
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| Compound Name |
methyl 4-[N-(3-hydroxypropanoyl)anilino]-1-(2-phenylethyl)piperidine-4-carboxylate
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| Structure |
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| Formula |
C24H30N2O4
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| Molecular Weight |
410.514
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| Canonical SMILES |
COC(=O)C1(CCN(CCc2ccccc2)CC1)N(C(=O)CCO)c1ccccc1
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| InChI |
InChI=1S/C24H30N2O4/c1-30-23(29)24(26(22(28)13-19-27)21-10-6-3-7-11-21)14-17-25(18-15-24)16-12-20-8-4-2-5-9-20/h2-11,27H,12-19H2,1H3
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| InChIKey |
UPLPXDPQOUENFQ-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