General Information of the Compound
| Compound ID |
CP0501520
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| Compound Name |
US9000044, 58
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| Structure |
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| Formula |
C19H16FNO4S
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| Molecular Weight |
373.405
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| Canonical SMILES |
Cc1c(CC(O)=O)cc2ccc(F)cc2c1-c1ccc(cn1)S(C)(=O)=O
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| InChI |
InChI=1S/C19H16FNO4S/c1-11-13(8-18(22)23)7-12-3-4-14(20)9-16(12)19(11)17-6-5-15(10-21-17)26(2,24)25/h3-7,9-10H,8H2,1-2H3,(H,22,23)
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| InChIKey |
BUJJZKPLHCGSFJ-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