COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052752
Chemical Name: 4-(pyrrolidin-1-ylcarbonothioyl)phenyl2-nitrobenzoate
Smiles: S=C(c1ccc(cc1)OC(=O)c1ccccc1[N+](=O)[O-])N1CCCC1

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Molecular Weight: 356.4
Empirical Formula: C18H16N2O4S

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 2.913
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 107
Number of rings: 3

     

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