COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK197775
Chemical Name: N-{1-[5-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}-2-(4-methoxyphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)c2ccc(cc2)Br)nnc1C(NC(=O)Cc1ccc(cc1)OC)C

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Molecular Weight: 529.46
Empirical Formula: C24H25BrN4O3S

Physical State: Dry powder
Available Amount: 220 mg

Lipinsky:
logP: 4.606
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 3

     

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