COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186992
Chemical Name: 2-{[5-{2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Smiles: C=CCn1c(nnc1SCC(=O)Nc1ccccc1F)CC(=O)Nc1ccc(c(c1)Cl)C

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Molecular Weight: 473.96
Empirical Formula: C22H21ClFN5O2S

Physical State: Dry powder
Available Amount: 125 mg

Lipinsky:
logP: 4.555
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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