COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK199399
Chemical Name: S-[5-methyl-4-({[2-(morpholin-4-yl)-5-nitrophenyl]carbonyl}amino)-4H-1,2,4-triazol-3-yl]2-(morpholin-4-yl)-5-nitrobenzenecarbothioate
Smiles: O=C(c1cc(ccc1N1CCOCC1)[N+](=O)[O-])Nn1c(C)nnc1SC(=O)c1cc(ccc1N1CCOCC1)[N+](=O)[O-]

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Molecular Weight: 598.6
Empirical Formula: C25H26N8O8S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 2.776
Rotatable bonds: 5
H-donors: 1
H-acceptors: 8
PSA: 218
Number of rings: 5

     

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