COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK696931
Chemical Name: 2-{[5-(morpholin-4-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-nitrophenyl)ethanone
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CSc1nnc(n1c1ccccc1)CN1CCOCC1

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Molecular Weight: 439.5
Empirical Formula: C21H21N5O4S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.099
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 131
Number of rings: 4

     

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