COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK420797
Chemical Name: methyl2-{[(4-bromophenyl)carbonyl]amino}-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)c2ccc(cc2)Br)sc2c1CCC(C2)C(CC)(C)C

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Molecular Weight: 464.42
Empirical Formula: C22H26BrNO3S

Physical State: Dry powder
Available Amount: 1644 mg

Lipinsky:
logP: 8.908
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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