COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK461842
Chemical Name: dimethyl5-{[(4-cyclohexylpiperazin-1-yl)carbonothioyl]amino}-3-methylthiophene-2,4-dicarboxylate
Smiles: COC(=O)c1c(NC(=S)N2CCN(CC2)C2CCCCC2)sc(c1C)C(=O)OC

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Molecular Weight: 439.6
Empirical Formula: C20H29N3O4S2

Physical State: Dry powder
Available Amount: 768 mg

Lipinsky:
logP: 5.388
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 131
Number of rings: 3

     

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