General Information of the Compound
| Compound ID |
CP0497452
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| Compound Name |
(1R,2R,3R,5R,6R)-2-Amino-6-fluoro-3-(3-phenyl-propoxy)-bicyclo[3.1.0]hexane-2,6-dicarboxylic acid
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| Structure |
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| Formula |
C17H20FNO5
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| Molecular Weight |
337.347
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| Canonical SMILES |
N[C@@]1([C@H]2[C@@H](C[C@H]1OCCCc1ccccc1)[C@]2(F)C(O)=O)C(O)=O
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| InChI |
InChI=1S/C17H20FNO5/c18-16(14(20)21)11-9-12(17(19,13(11)16)15(22)23)24-8-4-7-10-5-2-1-3-6-10/h1-3,5-6,11-13H,4,7-9,19H2,(H,20,21)(H,22,23)/t11-,12-,13+,16-,17+/m1/s1
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| InChIKey |
LWHNYGCBYGZRPD-XRQSXFTLSA-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