General Information of the Compound
| Compound ID |
CP0416676
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| Compound Name |
N'-hydroxy-N-[4-hydroxy-3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]heptanediamide
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| Structure |
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| Formula |
C21H22F3N3O5
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| Molecular Weight |
453.417
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| Canonical SMILES |
ONC(=O)CCCCCC(=O)Nc1ccc(O)c(c1)C(=O)Nc1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C21H22F3N3O5/c22-21(23,24)13-5-4-6-14(11-13)26-20(31)16-12-15(9-10-17(16)28)25-18(29)7-2-1-3-8-19(30)27-32/h4-6,9-12,28,32H,1-3,7-8H2,(H,25,29)(H,26,31)(H,27,30)
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| InChIKey |
WSKULMHBPVCLFC-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