COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK305155
Chemical Name: ethyl2-{[({5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(n2CC2CCCO2)Cn2ccc(n2)C)sc2c1CCCCC2

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Molecular Weight: 558.73
Empirical Formula: C26H34N6O4S2

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 5.569
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 166
Number of rings: 5

     

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