COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK587048
Chemical Name: N-(4-bromophenyl)-2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)Br)nnc1COc1ccc(cc1)Cl

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Molecular Weight: 493.81
Empirical Formula: C20H18BrClN4O2S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 6.044
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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