General Information of the Compound
| Compound ID |
CP0487102
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| Compound Name |
4-methoxy-N-[3-oxo-3-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]propyl]benzamide
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| Structure |
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| Formula |
C21H24N2O3
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| Molecular Weight |
352.434
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| Canonical SMILES |
COc1ccc(cc1)C(=O)NCCC(=O)N[C@@H]1CCCc2ccccc12
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| InChI |
InChI=1S/C21H24N2O3/c1-26-17-11-9-16(10-12-17)21(25)22-14-13-20(24)23-19-8-4-6-15-5-2-3-7-18(15)19/h2-3,5,7,9-12,19H,4,6,8,13-14H2,1H3,(H,22,25)(H,23,24)/t19-/m1/s1
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| InChIKey |
FOAKVRJLGKKMDS-LJQANCHMSA-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