General Information of the Compound
| Compound ID |
CP0573438
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| Compound Name |
2-[(4-fluorophenyl)methyl-[7-(hydroxyamino)-7-oxoheptyl]amino]-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide
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| Structure |
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| Formula |
C24H28FN5O3S
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| Molecular Weight |
485.585
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| Canonical SMILES |
ONC(=O)CCCCCCN(Cc1ccc(F)cc1)c1ncc(s1)C(=O)NCc1cccnc1
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| InChI |
InChI=1S/C24H28FN5O3S/c25-20-10-8-18(9-11-20)17-30(13-4-2-1-3-7-22(31)29-33)24-28-16-21(34-24)23(32)27-15-19-6-5-12-26-14-19/h5-6,8-12,14,16,33H,1-4,7,13,15,17H2,(H,27,32)(H,29,31)
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| InChIKey |
DGKUZYZFJOZWGX-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