COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245529
Chemical Name: N-{1-[5-({2-[(2,5-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]ethyl}-2-fluorobenzamide
Smiles: CCn1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nnc1C(NC(=O)c1ccccc1F)C

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Molecular Weight: 496.39
Empirical Formula: C21H20Cl2FN5O2S

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 3.821
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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