COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541175
Chemical Name: 3-(4-{[5-(3-nitrophenyl)furan-2-yl]carbonothioyl}piperazin-1-yl)propanenitrile
Smiles: N#CCCN1CCN(CC1)C(=S)c1ccc(o1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 370.43
Empirical Formula: C18H18N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.999
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 121
Number of rings: 3

     

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