General Information of the Compound
| Compound ID |
CP0905078
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| Compound Name |
(S)-2-((S)-2-acetamido-3-carboxypropanamido)pentanoic acid
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| Structure |
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| Formula |
C11H18N2O6
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| Molecular Weight |
274.273
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| Canonical SMILES |
CCC[C@H](NC(=O)[C@H](CC(=O)O)NC(C)=O)C(=O)O
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| InChI |
InChI=1S/C11H18N2O6/c1-3-4-7(11(18)19)13-10(17)8(5-9(15)16)12-6(2)14/h7-8H,3-5H2,1-2H3,(H,12,14)(H,13,17)(H,15,16)(H,18,19)/t7-,8-/m0/s1
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| InChIKey |
OJBRDBBNXHDEET-YUMQZZPRSA-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