COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051429
Chemical Name: 5-(4-fluorophenyl)-4-{[(E)-(3-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 343.34
Empirical Formula: C15H10FN5O2S

Physical State: Dry powder
Available Amount: 218 mg

Lipinsky:
logP: 2.628
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 117
Number of rings: 3

     

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