COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK697074
Chemical Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nnc1c1cccc(c1)OC

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Molecular Weight: 482.91
Empirical Formula: C21H18ClF3N4O2S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 6.251
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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