COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK111930
Chemical Name: 4-({2-[(5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitrophenyl}sulfonyl)morpholine
Smiles: Cn1c(nnc1Cc1ccccc1)Sc1ccc(cc1S(=O)(=O)N1CCOCC1)[N+](=O)[O-]

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Molecular Weight: 475.55
Empirical Formula: C20H21N5O5S2

Physical State: Dry powder
Available Amount: 352 mg

Lipinsky:
logP: 3.636
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 156
Number of rings: 4

     

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