COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL401248
Chemical Name: 2-methyl-N-{3-[(4-methylphenyl)sulfanyl]-5-nitrophenyl}-3-(4-nitro-1H-pyrazol-1-yl)propanamide
Smiles: Cc1ccc(cc1)Sc1cc(NC(=O)C(Cn2ncc(c2)[N+](=O)[O-])C)cc(c1)[N+](=O)[O-]

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Molecular Weight: 441.47
Empirical Formula: C20H19N5O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.271
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 163
Number of rings: 3

     

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