COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457552
Chemical Name: methyl2-({[4-(3,4-dichlorophenyl)piperazin-1-yl]carbonothioyl}amino)-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)N1CCN(CC1)c1ccc(c(c1)Cl)Cl)CC

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Molecular Weight: 543.54
Empirical Formula: C23H28Cl2N4O3S2

Physical State: Dry powder
Available Amount: 272 mg

Lipinsky:
logP: 6.217
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 125
Number of rings: 3

     

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