COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK023214
Chemical Name: 4-ethoxy-N-({4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}carbonothioyl)benzamide
Smiles: CCOc1ccc(cc1)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 482.48
Empirical Formula: C21H21F3N4O4S

Physical State: Dry powder
Available Amount: 288 mg

Lipinsky:
logP: 4.971
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 3

     

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