COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK922481
Chemical Name: 2-{[7-methoxy-4-(trifluoromethyl)quinolin-2-yl]sulfanyl}-1-(4-nitrothiophen-2-yl)ethanone
Smiles: COc1ccc2c(c1)nc(cc2C(F)(F)F)SCC(=O)c1scc(c1)[N+](=O)[O-]

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Molecular Weight: 428.41
Empirical Formula: C17H11F3N2O4S2

Physical State: Dry powder
Available Amount: 111 mg

Lipinsky:
logP: 4.675
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 138
Number of rings: 3

     

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