General Information of the Compound
| Compound ID |
CP0255899
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| Compound Name |
(S)-5-(2-Fluoro-phenyl)-2-(phosphonomethyl-amino)-pent-4-ynoic acid
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| Structure |
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| Formula |
C12H13FNO5P
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| Molecular Weight |
301.21
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| Canonical SMILES |
OC(=O)[C@H](CC#Cc1ccccc1F)NCP(O)(O)=O
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| InChI |
InChI=1S/C12H13FNO5P/c13-10-6-2-1-4-9(10)5-3-7-11(12(15)16)14-8-20(17,18)19/h1-2,4,6,11,14H,7-8H2,(H,15,16)(H2,17,18,19)/t11-/m0/s1
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| InChIKey |
PFOHNQZTJDQTGP-NSHDSACASA-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