COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807143
Chemical Name: 2-{[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-nitrophenyl)ethanone
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])CSc1nnc(n1c1ccccc1)C1COc2c(O1)cccc2

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Molecular Weight: 474.5
Empirical Formula: C24H18N4O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.389
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 137
Number of rings: 5

     

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