COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK123108
Chemical Name: 2-{[5-cyano-4-(3-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-nitrophenyl)acetamide
Smiles: N#Cc1c(=O)[nH]c(nc1c1cccc(c1)OC)SCC(=O)Nc1ccc(cc1)[N+](=O)[O-]

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Saltdata: HCl
Molecular Weight: 437.44
Empirical Formula: C20H15N5O5S

Physical State: Dry powder
Available Amount: 411 mg

Lipinsky:
logP: 2.96
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 174
Number of rings: 3

     

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