General Information of the Compound
| Compound ID |
CP0496771
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| Compound Name |
4-cyclohexyl-N-[3-methoxy-4-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]phenyl]benzamide
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| Structure |
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| Formula |
C26H34N2O3
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| Molecular Weight |
422.569
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| Canonical SMILES |
COc1cc(NC(=O)c2ccc(cc2)C2CCCCC2)ccc1OC[C@@H]1CCCN1C
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| InChI |
InChI=1S/C26H34N2O3/c1-28-16-6-9-23(28)18-31-24-15-14-22(17-25(24)30-2)27-26(29)21-12-10-20(11-13-21)19-7-4-3-5-8-19/h10-15,17,19,23H,3-9,16,18H2,1-2H3,(H,27,29)/t23-/m0/s1
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| InChIKey |
PPLBSYFHUWWKBI-QHCPKHFHSA-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