COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL092802
Chemical Name: ethyl3-[2-(3,4-dimethoxyphenyl)ethyl]-10-methoxy-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate
Smiles: CCOC(=O)C1C2NC(=S)N(C1(C)Oc1c2cccc1OC)CCc1ccc(c(c1)OC)OC

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Molecular Weight: 486.59
Empirical Formula: C25H30N2O6S

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 4.301
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 110
Number of rings: 4

     

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