COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL122260
Chemical Name: methyl2-[({[5-({[(4-bromophenyl)carbonyl]amino}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CSc1nnc(n1C)CNC(=O)c1ccc(cc1)Br

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Molecular Weight: 518.39
Empirical Formula: C21H20BrN5O4S

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 3.972
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 140
Number of rings: 3

     

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