General Information of the Compound
| Compound ID |
CP0497658
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| Compound Name |
(5-hydroxynaphthalen-1-yl) 2-chlorobenzoate
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| Structure |
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| Formula |
C17H11ClO3
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| Molecular Weight |
298.725
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| Canonical SMILES |
Oc1cccc2c(OC(=O)c3ccccc3Cl)cccc12
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| InChI |
InChI=1S/C17H11ClO3/c18-14-8-2-1-5-13(14)17(20)21-16-10-4-6-11-12(16)7-3-9-15(11)19/h1-10,19H
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| InChIKey |
QEYPLJNCGQVHSF-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
Protein ID: PT00886, Estrogen receptor
Protein ID: PT00889, Estrogen receptor beta