General Information of the Compound
| Compound ID |
CP0472154
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| Compound Name |
2-(2-piperidin-1-ylethoxy)-4-[4-(piperidin-1-ylmethyl)phenyl]-N-(3-piperidin-1-ylpropyl)aniline
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| Structure |
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| Formula |
C33H50N4O
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| Molecular Weight |
518.79
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| Canonical SMILES |
C(CNc1ccc(cc1OCCN1CCCCC1)-c1ccc(CN2CCCCC2)cc1)CN1CCCCC1
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| InChI |
InChI=1S/C33H50N4O/c1-4-18-35(19-5-1)24-10-17-34-32-16-15-31(27-33(32)38-26-25-36-20-6-2-7-21-36)30-13-11-29(12-14-30)28-37-22-8-3-9-23-37/h11-16,27,34H,1-10,17-26,28H2
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| InChIKey |
VRCXWVOKIOIRNA-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