COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK665404
Chemical Name: 4-({[5-(3-bromophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinolin-2(1H)-one
Smiles: C=CCn1c(SCc2cc(=O)[nH]c3c2cccc3)nnc1c1cccc(c1)Br

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Molecular Weight: 453.36
Empirical Formula: C21H17BrN4OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.952
Rotatable bonds: 6
H-donors: 1
H-acceptors: 1
PSA: 85
Number of rings: 4

     

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