COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK164065
Chemical Name: 5-bromo-N-({4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}carbonothioyl)naphthalene-1-carboxamide
Smiles: S=C(N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F)NC(=O)c1cccc2c1cccc2Br

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Molecular Weight: 567.39
Empirical Formula: C23H18BrF3N4O3S

Physical State: Dry powder
Available Amount: 275 mg

Lipinsky:
logP: 6.276
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 113
Number of rings: 4

     

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