COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL438822
Chemical Name: 2-(1H-benzotriazol-1-yl)-N-[2-{[4-(dimethylamino)phenyl]amino}-2-oxo-1-(thiophen-2-yl)ethyl]-N-(4-fluorobenzyl)acetamide
Smiles: Fc1ccc(cc1)CN(C(c1cccs1)C(=O)Nc1ccc(cc1)N(C)C)C(=O)Cn1nnc2c1cccc2

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Molecular Weight: 542.64
Empirical Formula: C29H27FN6O2S

Physical State: Dry powder
Available Amount: 246 mg

Lipinsky:
logP: 5.545
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 111
Number of rings: 5

     

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