General Information of the Compound
| Compound ID |
CP0371061
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| Compound Name |
1-(4-chlorooxazol-2-yl)-7-phenylheptan-1-one
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| Synonyms |
1-(4-chlorooxazol-2-yl)-7-phenylheptan-1-one
CHEMBL462432
SCHEMBL2162562
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| Structure |
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| Formula |
C16H18ClNO2
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| Molecular Weight |
291.778
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| Canonical SMILES |
Clc1coc(n1)C(=O)CCCCCCc1ccccc1
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| InChI |
InChI=1S/C16H18ClNO2/c17-15-12-20-16(18-15)14(19)11-7-2-1-4-8-13-9-5-3-6-10-13/h3,5-6,9-10,12H,1-2,4,7-8,11H2
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| InChIKey |
HEJGWGQTJYVGGY-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
Clinical Information about the Compound
Drug 1 ( 1-(4-chlorooxazol-2-yl)-7-phenylheptan-1-one )
| Drug Name | 1-(4-chlorooxazol-2-yl)-7-phenylheptan-1-one | ||
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