COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456188
Chemical Name: methyl2-({[4-(pyrrolidin-1-ylcarbonyl)phenyl]carbamothioyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)Nc2ccc(cc2)C(=O)N2CCCC2)sc2c1CCCCC2

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Molecular Weight: 457.62
Empirical Formula: C23H27N3O3S2

Physical State: Dry powder
Available Amount: 487 mg

Lipinsky:
logP: 5.088
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 131
Number of rings: 4

     

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