General Information of the Compound
| Compound ID |
CP0515474
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| Compound Name |
methyl (2S)-2-[[(2R)-2-(butylamino)-4-(hydroxyamino)-4-oxobutanoyl]amino]-4-methylpentanoate
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| Structure |
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| Formula |
C15H29N3O5
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| Molecular Weight |
331.413
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| Canonical SMILES |
CCCCN[C@H](CC(=O)NO)C(=O)N[C@@H](CC(C)C)C(=O)OC
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| InChI |
InChI=1S/C15H29N3O5/c1-5-6-7-16-11(9-13(19)18-22)14(20)17-12(8-10(2)3)15(21)23-4/h10-12,16,22H,5-9H2,1-4H3,(H,17,20)(H,18,19)/t11-,12+/m1/s1
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| InChIKey |
UNLPCLAWICVHGV-NEPJUHHUSA-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