COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473701
Chemical Name: dimethyl5-{[({4-methyl-5-[5-(propan-2-yl)thiophen-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(NC(=O)CSc2nnc(n2C)c2csc(c2)C(C)C)cc(c1)C(=O)OC

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Molecular Weight: 488.59
Empirical Formula: C22H24N4O5S2

Physical State: Dry powder
Available Amount: 377 mg

Lipinsky:
logP: 5.917
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 165
Number of rings: 3

     

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