General Information of the Compound
| Compound ID |
CP0547930
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| Compound Name |
3-(5-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoic acid
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| Structure |
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| Formula |
C10H8ClNO4
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| Molecular Weight |
241.63
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| Canonical SMILES |
OC(=O)CCn1c2cc(Cl)ccc2oc1=O
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| InChI |
InChI=1S/C10H8ClNO4/c11-6-1-2-8-7(5-6)12(10(15)16-8)4-3-9(13)14/h1-2,5H,3-4H2,(H,13,14)
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| InChIKey |
ODWSXTKSQNMMMQ-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