2-methoxy-α,β-didehydro-agomelatine [162]
2-methoxy-α,β-didehydro-agomelatine
| SMILES |
COc1ccc2ccc(OC)c(/C=C/NC(C)=O)c2c1 |
| InChIKey |
HMYFXYOFPXZULT-CMDGGOBGSA-N |
Chemical Properties
| Hydrogen bond acceptors |
3 |
| Hydrogen bond donors |
1 |
| Rotatable bonds |
4 |
| Log P |
2.964 |
| Molecular weight (Da) |
271.1 |
| Stereochemistry info |
unspecified |
Bioactivities
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Activity |
Source |
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Gene |
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Type |
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Avg |
Max |
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| Receptor |
Activity |
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Gene |
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2-methoxy-α,β-didehydro-agomelatine
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.