COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK106541
Chemical Name: 4-{[3-(benzyloxy)-4-methoxybenzylidene]amino}-5-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1OCc1ccccc1)/C=N\n1c(S)nnc1c1ccc(cc1)Cl

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Molecular Weight: 450.95
Empirical Formula: C23H19ClN4O2S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 7.368
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 4

     

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