COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK892223
Chemical Name: N-{[5-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]carbamothioyl}-2-(morpholin-4-yl)-5-nitrobenzamide
Smiles: CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=S)NC(=O)c1cc(ccc1N1CCOCC1)[N+](=O)[O-])C

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Molecular Weight: 552.64
Empirical Formula: C24H24N8O4S2

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 4.422
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 202
Number of rings: 5

     

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