General Information of the Compound
| Compound ID |
CP0106805
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| Compound Name |
N-[2-[[1-[(3-ethoxy-4-methoxyphenyl)methyl]piperidin-4-yl]amino]-1,3-benzoxazol-5-yl]acetamide
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| Structure |
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| Formula |
C24H30N4O4
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| Molecular Weight |
438.528
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| Canonical SMILES |
CCOc1cc(CN2CCC(CC2)Nc2nc3cc(NC(C)=O)ccc3o2)ccc1OC
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| InChI |
InChI=1S/C24H30N4O4/c1-4-31-23-13-17(5-7-22(23)30-3)15-28-11-9-18(10-12-28)26-24-27-20-14-19(25-16(2)29)6-8-21(20)32-24/h5-8,13-14,18H,4,9-12,15H2,1-3H3,(H,25,29)(H,26,27)
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| InChIKey |
XOEOXYIMADHJLD-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