COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806814
Chemical Name: 2-{[5-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-nitrophenyl)ethanone
Smiles: COc1ccc2c(c1)sc(c2Cl)c1nnc(n1c1ccccc1)SCC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 537.02
Empirical Formula: C25H17ClN4O4S2

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 8.532
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 156
Number of rings: 5

     

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