General Information of the Compound
| Compound ID |
CP0445436
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| Compound Name |
N-[3-[(3-chloro-4-fluorophenyl)carbamoyl]-4-hydroxyphenyl]-N'-hydroxyheptanediamide
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| Structure |
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| Formula |
C20H21ClFN3O5
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| Molecular Weight |
437.855
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| Canonical SMILES |
ONC(=O)CCCCCC(=O)Nc1ccc(O)c(c1)C(=O)Nc1ccc(F)c(Cl)c1
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| InChI |
InChI=1S/C20H21ClFN3O5/c21-15-11-13(6-8-16(15)22)24-20(29)14-10-12(7-9-17(14)26)23-18(27)4-2-1-3-5-19(28)25-30/h6-11,26,30H,1-5H2,(H,23,27)(H,24,29)(H,25,28)
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| InChIKey |
WXDPXOBBMKNNFY-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