COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK305015
Chemical Name: diethyl3-methyl-5-{[({5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}thiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(n2CC2CCCO2)Cn2ccc(n2)C)sc(c1C)C(=O)OCC

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Molecular Weight: 576.7
Empirical Formula: C25H32N6O6S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.888
Rotatable bonds: 13
H-donors: 1
H-acceptors: 6
PSA: 193
Number of rings: 4

     

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