COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK453052
Chemical Name: ethyl2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-4-(3-bromophenyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1cccc(c1)Br)NC(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 474.33
Empirical Formula: C21H16BrNO5S

Physical State: Dry powder
Available Amount: 515 mg

Lipinsky:
logP: 6.109
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 102
Number of rings: 4

     

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