COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK459592
Chemical Name: 1-[1-(3,4-dichlorobenzyl)-1H-1,2,4-triazol-3-yl]-3-(4-nitrophenyl)urea
Smiles: O=C(Nc1ncn(n1)Cc1ccc(c(c1)Cl)Cl)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 407.22
Empirical Formula: C16H12Cl2N6O3

Physical State: Dry powder
Available Amount: 187 mg

Lipinsky:
logP: 3.7
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 117
Number of rings: 3

     

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