COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK199505
Chemical Name: N-{[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl}-5-(2-nitrophenyl)furan-2-carboxamide
Smiles: S=C(Nc1cc(ccc1C)c1sc2n(n1)c(nn2)C)NC(=O)c1ccc(o1)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 519.56
Empirical Formula: C23H17N7O4S2

Physical State: Dry powder
Available Amount: 460 mg

Lipinsky:
logP: 4.247
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 203
Number of rings: 5

     

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