COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK133850
Chemical Name: 1-(morpholin-4-yl)-2-{[5-(4-nitrophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: O=C(N1CCOCC1)CSc1nnc(n1c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 425.47
Empirical Formula: C20H19N5O4S

Physical State: Dry powder
Available Amount: 88 mg

Lipinsky:
logP: 4.614
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 131
Number of rings: 4

     

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