COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL063827
Chemical Name: (2E)-N-{[4-(diprop-2-en-1-ylsulfamoyl)phenyl]carbamothioyl}-3-(4-fluorophenyl)prop-2-enamide
Smiles: C=CCN(S(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)F)CC=C

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Molecular Weight: 459.57
Empirical Formula: C22H22FN3O3S2

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 5.578
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 118
Number of rings: 2

     

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