COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL413482
Chemical Name: 4'-chloro-1,1''-dimethyl-1'-[(3-nitrophenyl)sulfonyl]-1H,1'H,1''H-4,3':5',4''-terpyrazole
Smiles: Cn1ncc(c1)c1c(Cl)c(nn1S(=O)(=O)c1cccc(c1)[N+](=O)[O-])c1cnn(c1)C

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Molecular Weight: 447.86
Empirical Formula: C17H14ClN7O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.199
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 141
Number of rings: 4

     

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