COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK306806
Chemical Name: 4-{[(E)-{3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl}methylidene]amino}-5-(difluoromethyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1COc1ccc(cc1)Cl)/C=N/n1c(S)nnc1C(F)F

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Molecular Weight: 424.86
Empirical Formula: C18H15ClF2N4O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.528
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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