COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK174163
Chemical Name: (2E,2'E)-N,N'-[(2-methylbenzene-1,4-diyl)dicarbamothioyl]bis{3-[4-(propan-2-yl)phenyl]prop-2-enamide}
Smiles: O=C(NC(=S)Nc1ccc(c(c1)C)NC(=S)NC(=O)/C=C/c1ccc(cc1)C(C)C)/C=C/c1ccc(cc1)C(C)C

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Molecular Weight: 584.81
Empirical Formula: C33H36N4O2S2

Physical State: Dry powder
Available Amount: 582 mg

Lipinsky:
logP: 8.109
Rotatable bonds: 2
H-donors: 4
H-acceptors: 2
PSA: 146
Number of rings: 3

     

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