COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839164
Chemical Name: propan-2-yl2-{[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CC(OC(=O)c1c(NC(=O)Cn2nc(c(c2C)Br)[N+](=O)[O-])sc2c1CCCC2)C

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Molecular Weight: 485.36
Empirical Formula: C18H21BrN4O5S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 5.57
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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