COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK012450
Chemical Name: N-(4,5-dihydro-1,3-thiazol-2-yl)-4-ethoxy-N-[(4-ethoxy-3-nitrophenyl)carbonyl]-3-nitrobenzamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)N(C(=O)c1ccc(c(c1)[N+](=O)[O-])OCC)C1=NCCS1

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Molecular Weight: 488.48
Empirical Formula: C21H20N4O8S

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 2.96
Rotatable bonds: 6
H-donors: 0
H-acceptors: 8
PSA: 185
Number of rings: 3

     

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