General Information of the Compound
| Compound ID |
CP0486666
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| Compound Name |
(E)-3-(furan-2-yl)prop-2-enoic acid
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| Structure |
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| Formula |
C7H6O3
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| Molecular Weight |
138.122
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| Canonical SMILES |
OC(=O)\C=C\c1ccco1
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| InChI |
InChI=1S/C7H6O3/c8-7(9)4-3-6-2-1-5-10-6/h1-5H,(H,8,9)/b4-3+
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| InChIKey |
ZCJLOOJRNPHKAV-ONEGZZNKSA-N
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| CAS |
15690-24-1
539-47-9
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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