COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL376846
Chemical Name: ethyl6-tert-butyl-2-{[(4H-1,2,4-triazol-3-ylsulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc[nH]2)sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 422.57
Empirical Formula: C19H26N4O3S2

Physical State: Dry powder
Available Amount: 605 mg

Lipinsky:
logP: 5.152
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 150
Number of rings: 3

     

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