COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186722
Chemical Name: 2-bromo-N-{[4-ethyl-5-({2-[(3-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1CC)CNC(=O)c1ccccc1Br

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Molecular Weight: 504.41
Empirical Formula: C21H22BrN5O3S

Physical State: Dry powder
Available Amount: 174 mg

Lipinsky:
logP: 3.514
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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