COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL234848
Chemical Name: methyl2-[({4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}carbonothioyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=S)N1CCN(CC1)CC(=O)N(C)C

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Saltdata: (CH3)2NCO
Molecular Weight: 364.47
Empirical Formula: C17H24N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.544
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 97
Number of rings: 2

     

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