General Information of the Compound
| Compound ID |
CP0853781
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| Compound Name |
2-Amino-bicyclo[2.1.1]hexane-2,5-dicarboxylic acid
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| Structure |
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| Formula |
C8H11NO4
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| Molecular Weight |
185.179
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| Canonical SMILES |
NC1(C(=O)O)CC2CC1C2C(=O)O
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| InChI |
InChI=1S/C8H11NO4/c9-8(7(12)13)2-3-1-4(8)5(3)6(10)11/h3-5H,1-2,9H2,(H,10,11)(H,12,13)
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| InChIKey |
JCGJEPFYMOHIDP-UHFFFAOYSA-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