COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK542443
Chemical Name: (2E)-N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]-3-phenylprop-2-enamide
Smiles: S=C(Nc1cc(cc(c1O)Cl)[N+](=O)[O-])NC(=O)/C=C/c1ccccc1

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Molecular Weight: 377.81
Empirical Formula: C16H12ClN3O4S

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 5.264
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 139
Number of rings: 2

     

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