COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL089305
Chemical Name: 6-tert-butyl-2-{[(4-ethoxy-3-nitrophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1sc2c(c1C(=O)N)CCC(C2)C(C)(C)C

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Molecular Weight: 445.54
Empirical Formula: C22H27N3O5S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 6.52
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 155
Number of rings: 3

     

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