General Information of the Compound
| Compound ID |
CP0377026
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| Compound Name |
5-hydroxy-2-(3-(6-hydroxynaphthalen-2-yl)propanamido)cyclohex-1-enecarboxylic acid
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| Structure |
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| Formula |
C20H21NO5
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| Molecular Weight |
355.39
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| Canonical SMILES |
OC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C1)C(O)=O
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| InChI |
InChI=1S/C20H21NO5/c22-15-5-4-13-9-12(1-3-14(13)10-15)2-8-19(24)21-18-7-6-16(23)11-17(18)20(25)26/h1,3-5,9-10,16,22-23H,2,6-8,11H2,(H,21,24)(H,25,26)
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| InChIKey |
CIQTZWSZWNISGL-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