General Information of the Compound
| Compound ID |
CP0254569
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| Compound Name |
2-[(4-fluorophenyl)methyl-[6-(hydroxyamino)-6-oxohexyl]amino]-N-(3-imidazol-1-ylpropyl)-1,3-thiazole-5-carboxamide
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| Structure |
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| Formula |
C23H29FN6O3S
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| Molecular Weight |
488.589
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| Canonical SMILES |
ONC(=O)CCCCCN(Cc1ccc(F)cc1)c1ncc(s1)C(=O)NCCCn1ccnc1
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| InChI |
InChI=1S/C23H29FN6O3S/c24-19-8-6-18(7-9-19)16-30(13-3-1-2-5-21(31)28-33)23-27-15-20(34-23)22(32)26-10-4-12-29-14-11-25-17-29/h6-9,11,14-15,17,33H,1-5,10,12-13,16H2,(H,26,32)(H,28,31)
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| InChIKey |
XYGJYMRXHGHGNB-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