COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK130059
Chemical Name: 2-{[4-benzyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethanone
Smiles: O=C(N1CCOCC1)CSc1nnc(n1Cc1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 439.5
Empirical Formula: C21H21N5O4S

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 4.201
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 131
Number of rings: 4

     

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