COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457550
Chemical Name: methyl2-({[4-(3,4-dichlorophenyl)piperazin-1-yl]carbonothioyl}amino)-4-ethyl-5-methylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)N2CCN(CC2)c2ccc(c(c2)Cl)Cl)sc(c1CC)C

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Molecular Weight: 472.46
Empirical Formula: C20H23Cl2N3O2S2

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 6.664
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 105
Number of rings: 3

     

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