COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK059034
Chemical Name: methyl3-nitro-5-{[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]carbamoyl}benzoate
Smiles: COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1nnc(s1)C(F)(F)F

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Molecular Weight: 376.27
Empirical Formula: C12H7F3N4O5S

Physical State: Dry powder
Available Amount: 331 mg

Lipinsky:
logP: 2.613
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 2

     

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