General Information of the Compound
| Compound ID |
CP0511136
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| Compound Name |
N-[4-[4-(2-methoxyanilino)piperidin-1-yl]butyl]naphthalene-2-carboxamide
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| Structure |
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| Formula |
C27H33N3O2
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| Molecular Weight |
431.58
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| Canonical SMILES |
COc1ccccc1NC1CCN(CCCCNC(=O)c2ccc3ccccc3c2)CC1
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| InChI |
InChI=1S/C27H33N3O2/c1-32-26-11-5-4-10-25(26)29-24-14-18-30(19-15-24)17-7-6-16-28-27(31)23-13-12-21-8-2-3-9-22(21)20-23/h2-5,8-13,20,24,29H,6-7,14-19H2,1H3,(H,28,31)
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| InChIKey |
JKUARXXFZBUSAL-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
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor