COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245831
Chemical Name: 4-chloro-N-[2-(5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Smiles: CCn1c(CCNC(=O)c2ccc(cc2)Cl)nnc1SCC(=O)c1ccc(cc1)Cl

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Molecular Weight: 463.39
Empirical Formula: C21H20Cl2N4O2S

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 5.085
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 102
Number of rings: 3

     

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