COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139671
Chemical Name: 3-[(4-bromobenzyl)sulfanyl]-5-(7-methoxy-1-benzofuran-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Smiles: C=CCn1c(nnc1c1cc2c(o1)c(OC)ccc2)SCc1ccc(cc1)Br

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Molecular Weight: 456.36
Empirical Formula: C21H18BrN3O2S

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 6.139
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 78
Number of rings: 4

     

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