COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472727
Chemical Name: ethyl2-[({4-[(3,4-dimethylphenyl)sulfonyl]piperazin-1-yl}carbonothioyl)amino]-5-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1cc(sc1NC(=S)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C)C)c1ccccc1

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Molecular Weight: 543.73
Empirical Formula: C26H29N3O4S3

Physical State: Dry powder
Available Amount: 426 mg

Lipinsky:
logP: 6.964
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 147
Number of rings: 4

     

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