COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK462673
Chemical Name: methyl5-methyl-2-({[3-methyl-4-(4-methylphenyl)piperazin-1-yl]carbonothioyl}amino)thiophene-3-carboxylate
Smiles: COC(=O)c1cc(sc1NC(=S)N1CCN(C(C1)C)c1ccc(cc1)C)C

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Molecular Weight: 403.57
Empirical Formula: C20H25N3O2S2

Physical State: Dry powder
Available Amount: 951 mg

Lipinsky:
logP: 5.064
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 105
Number of rings: 3

     

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