COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380112
Chemical Name: ethyl2-{[(4-bromophenyl)carbonyl]amino}-6-cyano-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCC(C2)(C#N)c1ccccc1)NC(=O)c1ccc(cc1)Br

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Molecular Weight: 509.42
Empirical Formula: C25H21BrN2O3S

Physical State: Dry powder
Available Amount: 189 mg

Lipinsky:
logP: 7.488
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 4

     

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