COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457529
Chemical Name: methyl5-(diethylcarbamoyl)-4-methyl-2-({[4-(methylsulfonyl)piperazin-1-yl]carbonothioyl}amino)thiophene-3-carboxylate
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)N1CCN(CC1)S(=O)(=O)C)CC

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Molecular Weight: 476.64
Empirical Formula: C18H28N4O5S3

Physical State: Dry powder
Available Amount: 342 mg

Lipinsky:
logP: 2.851
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 167
Number of rings: 2

     

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