COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK678423
Chemical Name: ethyl4-[({4-[2-({(E)-[1-(4-fluorophenyl)-5-oxo-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)ethyl]piperazin-1-yl}carbonothioyl)amino]benzoate
Smiles: CCCC1=NN(C(=O)/C/1=C/NCCN1CCN(CC1)C(=S)Nc1ccc(cc1)C(=O)OCC)c1ccc(cc1)F

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Molecular Weight: 566.7
Empirical Formula: C29H35FN6O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.946
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 121
Number of rings: 4

     

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