COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK454451
Chemical Name: 1-[1-(4-fluorobenzyl)-1H-1,2,4-triazol-3-yl]-3-(3-nitrophenyl)thiourea
Smiles: S=C(Nc1ncn(n1)Cc1ccc(cc1)F)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 372.38
Empirical Formula: C16H13FN6O2S

Physical State: Dry powder
Available Amount: 550 mg

Lipinsky:
logP: 3.218
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 132
Number of rings: 3

     

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