COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL330631
Chemical Name: propan-2-yl2-{[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CC1CCc2c(C1)sc(c2C(=O)OC(C)C)NC(=O)Cn1nc(c(c1C)Br)[N+](=O)[O-]

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Molecular Weight: 499.39
Empirical Formula: C19H23BrN4O5S

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 6.062
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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