compound 4b [PMID: 19683441] [2286]
compound 4b [PMID: 19683441]
| SMILES |
CCO/N=C(\c1ccc(F)c(F)c1)c1ccc(CN2CCC3(CC2)OCc2cn(C)c(=O)cc23)cn1 |
| InChIKey |
FPPIDMVDDSIXTQ-GKPLWNPISA-N |
Chemical Properties
| Hydrogen bond acceptors |
7 |
| Hydrogen bond donors |
0 |
| Rotatable bonds |
6 |
| Log P |
3.869 |
| Molecular weight (Da) |
494.2 |
| Stereochemistry info |
unspecified |
Bioactivities
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| Receptor |
Activity |
Source |
| Protein |
Gene |
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Type |
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Avg |
Max |
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| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
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Type |
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Avg |
Max |
Database |
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compound 4b [PMID: 19683441]
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.