General Information of the Compound
| Compound ID |
CP0528462
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| Compound Name |
methyl (2S)-3-(4-bromophenyl)-2-[[9-(hydroxyamino)-9-oxononanoyl]amino]propanoate
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| Structure |
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| Formula |
C19H27BrN2O5
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| Molecular Weight |
443.338
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| Canonical SMILES |
COC(=O)[C@H](Cc1ccc(Br)cc1)NC(=O)CCCCCCCC(=O)NO
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| InChI |
InChI=1S/C19H27BrN2O5/c1-27-19(25)16(13-14-9-11-15(20)12-10-14)21-17(23)7-5-3-2-4-6-8-18(24)22-26/h9-12,16,26H,2-8,13H2,1H3,(H,21,23)(H,22,24)/t16-/m0/s1
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| InChIKey |
LPSYBPXEZGCRHK-INIZCTEOSA-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