COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK328902
Chemical Name: (2E)-3-(4-bromophenyl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide
Smiles: S=C(Nc1ccc(cc1O)[N+](=O)[O-])NC(=O)/C=C/c1ccc(cc1)Br

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Molecular Weight: 422.26
Empirical Formula: C16H12BrN3O4S

Physical State: Dry powder
Available Amount: 365 mg

Lipinsky:
logP: 5.497
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 139
Number of rings: 2

     

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