General Information of the Compound
| Compound ID |
CP0371981
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| Compound Name |
(S)(+)-7-methyl-2-p-tolylchroman-4-one
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| Synonyms |
(S)(+)-7-methyl-2-p-tolylchroman-4-one
CHEMBL600384
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| Structure |
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| Formula |
C17H16O2
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| Molecular Weight |
252.313
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| Canonical SMILES |
Cc1ccc(cc1)[C@@H]1CC(=O)c2ccc(C)cc2O1
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| InChI |
InChI=1S/C17H16O2/c1-11-3-6-13(7-4-11)16-10-15(18)14-8-5-12(2)9-17(14)19-16/h3-9,16H,10H2,1-2H3/t16-/m0/s1
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| InChIKey |
MIEPNGHJBCGJAW-INIZCTEOSA-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