COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL122923
Chemical Name: N-[(5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-4-methylbenzamide
Smiles: CCn1c(SCC(=O)c2ccc(cc2)Cl)nnc1CNC(=O)c1ccc(cc1)C

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Molecular Weight: 428.94
Empirical Formula: C21H21ClN4O2S

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 4.613
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 102
Number of rings: 3

     

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