compound 5b [PMID: 17358052] [2318]
compound 5b [PMID: 17358052]
| SMILES |
CCC1(c2ccccc2)OC(C(=O)O)=CC1=O |
| InChIKey |
SUHZZFNDVLWPTL-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors |
3 |
| Hydrogen bond donors |
1 |
| Rotatable bonds |
3 |
| Log P |
1.860 |
| Molecular weight (Da) |
232.1 |
| Stereochemistry info |
unspecified |
Bioactivities
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| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
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Class |
Type |
Min |
Avg |
Max |
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| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
Family |
Class |
Type |
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Avg |
Max |
Database |
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compound 5b [PMID: 17358052]
Drug properties
| Molecular type |
Small molecule |
| Physiological/Surrogate |
Surrogate |
| Approved drug |
No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0
Compound is not listed as a drug.