COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK140276
Chemical Name: [4-(2-hydroxyethyl)piperazin-1-yl](4-nitrophenyl)methanethione
Smiles: OCCN1CCN(CC1)C(=S)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 295.36
Empirical Formula: C13H17N3O3S

Physical State: Dry powder
Available Amount: 262 mg

Lipinsky:
logP: 0.938
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 2

     

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