COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK438839
Chemical Name: ethyl2-({[4-(2,6-dichlorobenzyl)piperazin-1-yl]carbonothioyl}amino)-5-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1cc(sc1NC(=S)N1CCN(CC1)Cc1c(Cl)cccc1Cl)c1ccccc1

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Molecular Weight: 534.53
Empirical Formula: C25H25Cl2N3O2S2

Physical State: Dry powder
Available Amount: 680 mg

Lipinsky:
logP: 7.497
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 105
Number of rings: 4

     

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