COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK783082
Chemical Name: methyl2-({4-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-3-nitrophenyl}carbonyl)benzoate
Smiles: COC(=O)c1ccccc1C(=O)c1ccc(c(c1)[N+](=O)[O-])Sc1nc(C)cc(n1)C

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Molecular Weight: 423.45
Empirical Formula: C21H17N3O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.177
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 140
Number of rings: 3

     

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