COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK051605
Chemical Name: (2E)-2-cyano-3-[2-(dimethylamino)-5-nitrophenyl]-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Smiles: N#C/C(=C\c1cc(ccc1N(C)C)[N+](=O)[O-])/C(=O)Nc1nnc(s1)C(F)(F)F

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Molecular Weight: 412.35
Empirical Formula: C15H11F3N6O3S

Available Amount: 0 mg

Lipinsky:
logP: 3.748
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 155
Number of rings: 2

     

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