General Information of the Compound
| Compound ID |
CP0575122
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| Compound Name |
N-[[4-tert-butyl-2-(4-methylpiperidin-1-yl)phenyl]methyl]-2-(2,3-dihydro-1H-inden-5-yl)propanamide
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| Structure |
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| Formula |
C29H40N2O
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| Molecular Weight |
432.652
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| Canonical SMILES |
CC(C(=O)NCc1ccc(cc1N1CCC(C)CC1)C(C)(C)C)c1ccc2CCCc2c1
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| InChI |
InChI=1S/C29H40N2O/c1-20-13-15-31(16-14-20)27-18-26(29(3,4)5)12-11-25(27)19-30-28(32)21(2)23-10-9-22-7-6-8-24(22)17-23/h9-12,17-18,20-21H,6-8,13-16,19H2,1-5H3,(H,30,32)
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| InChIKey |
ICBOCNITRPDLRY-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