COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK118423
Chemical Name: N-[1-(5-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-2-methylpropyl]-4-chlorobenzamide
Smiles: Clc1ccc(cc1)C(=O)NC(c1nnc(n1C)SCC(=O)c1ccc(cc1)Br)C(C)C

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Molecular Weight: 521.87
Empirical Formula: C22H22BrClN4O2S

Physical State: Dry powder
Available Amount: 179 mg

Lipinsky:
logP: 5.692
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 102
Number of rings: 3

     

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