COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK995677
Chemical Name: ethyl(7Z)-2-(acetylamino)-7-{[(4-bromophenoxy)carbonyl]imino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1CCC/C/2=N/C(=O)Oc1ccc(cc1)Br

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Molecular Weight: 479.35
Empirical Formula: C20H19BrN2O5S

Physical State: Dry powder
Available Amount: 545 mg

Lipinsky:
logP: 5.185
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 122
Number of rings: 3

     

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