COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK240048
Chemical Name: 3-{4-[(4-nitrophenyl)sulfanyl]benzyl}-1,2,3-benzotriazin-4(3H)-one
Smiles: O=c1n(nnc2c1cccc2)Cc1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 390.42
Empirical Formula: C20H14N4O3S

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 4.416
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 116
Number of rings: 4

     

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