COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK083960
Chemical Name: 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-[(6-nitro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)sulfanyl]pyrimidin-4-olate
Smiles: [O-]c1cc(CSc2ccc(cc2)Cl)nc(n1)Sc1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)[N+](=O)[O-]

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Saltdata: Na+
Molecular Weight: 548.02
Empirical Formula: C26H16ClN4O4S2

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 6.493
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 174
Number of rings: 5

     

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