General Information of the Compound
| Compound ID |
CP0436519
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| Compound Name |
(1R,2R,3R,5R,6R)-2-Amino-6-fluoro-3-((S)-1-naphthalen-2-yl-ethoxy)-bicyclo[3.1.0]hexane-2,6-dicarboxylic acid
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| Structure |
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| Formula |
C20H20FNO5
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| Molecular Weight |
373.38
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| Canonical SMILES |
C[C@H](O[C@@H]1C[C@@H]2[C@@H]([C@@]2(F)C(O)=O)[C@]1(N)C(O)=O)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C20H20FNO5/c1-10(12-7-6-11-4-2-3-5-13(11)8-12)27-15-9-14-16(19(14,21)17(23)24)20(15,22)18(25)26/h2-8,10,14-16H,9,22H2,1H3,(H,23,24)(H,25,26)/t10-,14+,15+,16-,19+,20-/m0/s1
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| InChIKey |
ZXUNQFXSGBYNQK-HHYUCLALSA-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