COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK015573
Chemical Name: 4-bromo-2-(morpholin-4-ylcarbonothioyl)phenyl4-chloro-3-nitrobenzoate
Smiles: Brc1ccc(c(c1)C(=S)N1CCOCC1)OC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 485.74
Empirical Formula: C18H14BrClN2O5S

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 3.174
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 116
Number of rings: 3

     

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