General Information of the Compound
| Compound ID |
CP0309750
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| Compound Name |
N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-3-methylbutanamide
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| Structure |
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| Formula |
C20H33N3O2
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| Molecular Weight |
347.503
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| Canonical SMILES |
COc1ccccc1N1CCN(CCCCNC(=O)CC(C)C)CC1
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| InChI |
InChI=1S/C20H33N3O2/c1-17(2)16-20(24)21-10-6-7-11-22-12-14-23(15-13-22)18-8-4-5-9-19(18)25-3/h4-5,8-9,17H,6-7,10-16H2,1-3H3,(H,21,24)
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| InChIKey |
RIQSGWHIWLLRTP-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