COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK446371
Chemical Name: ethyl4-ethyl-2-({[4-(4-hydroxyphenyl)piperazin-1-yl]carbonothioyl}amino)-5-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)N2CCN(CC2)c2ccc(cc2)O)sc(c1CC)C

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Molecular Weight: 433.6
Empirical Formula: C21H27N3O3S2

Physical State: Dry powder
Available Amount: 482 mg

Lipinsky:
logP: 4.898
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 125
Number of rings: 3

     

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