General Information of the Compound
| Compound ID |
CP0501408
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| Compound Name |
2-((R)-4-Amino-4-carboxybutanamido)-6-dodecanamidoheptanedioic Acid
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| Structure |
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| Formula |
C24H43N3O8
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| Molecular Weight |
501.621
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| Canonical SMILES |
CCCCCCCCCCCC(=O)NC(CCCC(NC(=O)CC[C@@H](N)C(O)=O)C(O)=O)C(O)=O
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| InChI |
InChI=1S/C24H43N3O8/c1-2-3-4-5-6-7-8-9-10-14-20(28)26-18(23(32)33)12-11-13-19(24(34)35)27-21(29)16-15-17(25)22(30)31/h17-19H,2-16,25H2,1H3,(H,26,28)(H,27,29)(H,30,31)(H,32,33)(H,34,35)/t17-,18?,19?/m1/s1
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| InChIKey |
OKSATHLTROVBTJ-LMDPOFIKSA-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