General Information of the Compound
| Compound ID |
CP0374557
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| Compound Name |
2-[4-[[4-(3,5-dimethylpyrazol-1-yl)phenyl]methoxy]piperidin-1-yl]-N-methylethanamine
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| Structure |
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| Formula |
C20H30N4O
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| Molecular Weight |
342.487
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| Canonical SMILES |
CNCCN1CCC(CC1)OCc1ccc(cc1)-n1nc(C)cc1C
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| InChI |
InChI=1S/C20H30N4O/c1-16-14-17(2)24(22-16)19-6-4-18(5-7-19)15-25-20-8-11-23(12-9-20)13-10-21-3/h4-7,14,20-21H,8-13,15H2,1-3H3
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| InChIKey |
DBWNSLHFKVEMFR-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