COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL436444
Chemical Name: (4-benzylpiperazin-1-yl)(4-nitrophenyl)methanethione
Smiles: S=C(c1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 341.43
Empirical Formula: C18H19N3O2S

Physical State: Dry powder
Available Amount: 238 mg

Lipinsky:
logP: 2.744
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 84
Number of rings: 3

     

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