COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472782
Chemical Name: methyl2-[({4-[(4-butylphenyl)sulfonyl]piperazin-1-yl}carbonothioyl)amino]-4,5-dimethylthiophene-3-carboxylate
Smiles: CCCCc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=S)Nc1sc(c(c1C(=O)OC)C)C

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Molecular Weight: 509.71
Empirical Formula: C23H31N3O4S3

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 6.603
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 147
Number of rings: 3

     

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