General Information of the Compound
| Compound ID |
CP0511898
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| Compound Name |
N-(3-amino-3-oxopropyl)-2,4-dichloro-3-(4-methoxy-3-propan-2-ylphenoxy)benzamide
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| Formula |
C20H22Cl2N2O4
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| Molecular Weight |
425.312
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| Canonical SMILES |
COc1ccc(Oc2c(Cl)ccc(C(=O)NCCC(N)=O)c2Cl)cc1C(C)C
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| InChI |
InChI=1S/C20H22Cl2N2O4/c1-11(2)14-10-12(4-7-16(14)27-3)28-19-15(21)6-5-13(18(19)22)20(26)24-9-8-17(23)25/h4-7,10-11H,8-9H2,1-3H3,(H2,23,25)(H,24,26)
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| InChIKey |
FFXOHCKDRXSKQS-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