General Information of the Compound
| Compound ID |
CP0453695
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| Compound Name |
4-cyclohexyl-N-[3-methoxy-4-(1-methylpyrrolidin-3-yl)oxyphenyl]benzamide
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| Structure |
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| Formula |
C25H32N2O3
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| Molecular Weight |
408.542
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| Canonical SMILES |
COc1cc(NC(=O)c2ccc(cc2)C2CCCCC2)ccc1OC1CCN(C)C1
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| InChI |
InChI=1S/C25H32N2O3/c1-27-15-14-22(17-27)30-23-13-12-21(16-24(23)29-2)26-25(28)20-10-8-19(9-11-20)18-6-4-3-5-7-18/h8-13,16,18,22H,3-7,14-15,17H2,1-2H3,(H,26,28)
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| InChIKey |
SYLMCKIDPXBTJT-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