COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302846
Chemical Name: ethyl5-acetyl-4-methyl-2-[({[5-(1-methyl-1H-pyrazol-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(n2CC2CCCO2)c2ccn(n2)C)sc(c1C)C(=O)C

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Molecular Weight: 532.64
Empirical Formula: C23H28N6O5S2

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 3.369
Rotatable bonds: 10
H-donors: 1
H-acceptors: 5
PSA: 183
Number of rings: 4

     

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