COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK117034
Chemical Name: methyl2-chloro-5-[({[4-ethyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1cc(ccc1Cl)NC(=O)CSc1nnc(n1CC)COc1ccccc1

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Molecular Weight: 460.94
Empirical Formula: C21H21ClN4O4S

Physical State: Dry powder
Available Amount: 153 mg

Lipinsky:
logP: 4.864
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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