COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL305178
Chemical Name: 2-(2,4-dimethoxyphenyl)-2,3,6,7,11,12-hexahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinolin-4-one
Smiles: COc1ccc(c(c1)OC)C1CC(=O)N2C(=C1)c1cc3OCCCOc3cc1CC2

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Molecular Weight: 407.47
Empirical Formula: C24H25NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.714
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 5

     

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