General Information of the Compound
| Compound ID |
CP0451093
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| Compound Name |
4-phenyl-2-(2-piperidin-1-ylethoxy)-N-(3-piperidin-1-ylpropyl)aniline
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| Structure |
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| Formula |
C27H39N3O
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| Molecular Weight |
421.629
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| Canonical SMILES |
C(CNc1ccc(cc1OCCN1CCCCC1)-c1ccccc1)CN1CCCCC1
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| InChI |
InChI=1S/C27H39N3O/c1-4-11-24(12-5-1)25-13-14-26(28-15-10-20-29-16-6-2-7-17-29)27(23-25)31-22-21-30-18-8-3-9-19-30/h1,4-5,11-14,23,28H,2-3,6-10,15-22H2
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| InChIKey |
QJJRZILWWXMMQK-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