COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK098357
Chemical Name: 2-ethoxy-4-(pyrrolidin-1-ylcarbonothioyl)phenyl2-chloro-4-nitrobenzoate
Smiles: CCOc1cc(ccc1OC(=O)c1ccc(cc1Cl)[N+](=O)[O-])C(=S)N1CCCC1

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Molecular Weight: 434.9
Empirical Formula: C20H19ClN2O5S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 4.353
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 116
Number of rings: 3

     

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