COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455502
Chemical Name: N-(2-methoxy-4-nitrophenyl)-4-(tetrahydrofuran-2-ylcarbonyl)piperazine-1-carbothioamide
Smiles: COc1cc(ccc1NC(=S)N1CCN(CC1)C(=O)C1CCCO1)[N+](=O)[O-]

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Molecular Weight: 394.45
Empirical Formula: C17H22N4O5S

Physical State: Dry powder
Available Amount: 343 mg

Lipinsky:
logP: 0.674
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 3

     

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