COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK251956
Chemical Name: 4-ethoxy-3-nitro-N-{[2-(pyrrolidin-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cc(ccc1N1CCCC1)C(F)(F)F

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Molecular Weight: 482.48
Empirical Formula: C21H21F3N4O4S

Physical State: Dry powder
Available Amount: 755 mg

Lipinsky:
logP: 5.519
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 131
Number of rings: 3

     

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