General Information of the Compound
| Compound ID |
CP0453972
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| Compound Name |
1-[4-[4-(5-methyl-1-naphthalen-2-ylpyrazol-3-yl)oxybutyl]piperazin-1-yl]ethanone
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| Structure |
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| Formula |
C24H30N4O2
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| Molecular Weight |
406.53
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| Canonical SMILES |
CC(=O)N1CCN(CCCCOc2cc(C)n(n2)-c2ccc3ccccc3c2)CC1
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| InChI |
InChI=1S/C24H30N4O2/c1-19-17-24(25-28(19)23-10-9-21-7-3-4-8-22(21)18-23)30-16-6-5-11-26-12-14-27(15-13-26)20(2)29/h3-4,7-10,17-18H,5-6,11-16H2,1-2H3
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| InChIKey |
CFSALKPOOGZGNM-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