General Information of the Compound
| Compound ID |
CP0505722
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| Compound Name |
2-Amino-6-((R)-4-carboxy-4-(dodecylamino)butanamido)heptanedioic Acid
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| Structure |
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| Formula |
C24H45N3O7
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| Molecular Weight |
487.638
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| Canonical SMILES |
CCCCCCCCCCCCN[C@H](CCC(=O)NC(CCCC(N)C(O)=O)C(O)=O)C(O)=O
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| InChI |
InChI=1S/C24H45N3O7/c1-2-3-4-5-6-7-8-9-10-11-17-26-19(23(31)32)15-16-21(28)27-20(24(33)34)14-12-13-18(25)22(29)30/h18-20,26H,2-17,25H2,1H3,(H,27,28)(H,29,30)(H,31,32)(H,33,34)/t18?,19-,20?/m1/s1
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| InChIKey |
HQDXDMGSWLFKSN-IOJLRTSASA-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