COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK422896
Chemical Name: methyl2-{[(5-bromothiophen-2-yl)carbonyl]amino}-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)c2ccc(s2)Br)sc2c1CCC(C2)c1ccccc1

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Molecular Weight: 476.41
Empirical Formula: C21H18BrNO3S2

Physical State: Dry powder
Available Amount: 2206 mg

Lipinsky:
logP: 7.935
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 4

     

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