General Information of the Compound
| Compound ID |
CP0504353
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| Compound Name |
5-(2-fluorophenyl)-2-(3-(6-hydroxynaphthalen-2-yl)propanamido)cyclohex-1-enecarboxylic acid
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| Structure |
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| Formula |
C26H24FNO4
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| Molecular Weight |
433.479
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| Canonical SMILES |
OC(=O)C1=C(CCC(C1)c1ccccc1F)NC(=O)CCc1ccc2cc(O)ccc2c1
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| InChI |
InChI=1S/C26H24FNO4/c27-23-4-2-1-3-21(23)19-9-11-24(22(15-19)26(31)32)28-25(30)12-6-16-5-7-18-14-20(29)10-8-17(18)13-16/h1-5,7-8,10,13-14,19,29H,6,9,11-12,15H2,(H,28,30)(H,31,32)
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| InChIKey |
MTWZGMIQVUHNAR-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