COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK122484
Chemical Name: 4-(naphthalen-2-ylsulfanyl)but-2-yn-1-yl4-nitrobenzoate
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])OCC#CCSc1ccc2c(c1)cccc2

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Molecular Weight: 377.42
Empirical Formula: C21H15NO4S

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 5.911
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 97
Number of rings: 3

     

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