COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK155701
Chemical Name: N-{[4-(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(NC(=O)c1ccc(o1)c1ccccc1[N+](=O)[O-])Nc1ccc(cc1)c1nn2c(s1)nnc2C

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Molecular Weight: 505.54
Empirical Formula: C22H15N7O4S2

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 3.87
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 203
Number of rings: 5

     

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