COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK307050
Chemical Name: 4-{[(E)-{3-[(2-chloro-4-nitrophenoxy)methyl]-4-methoxyphenyl}methylidene]amino}-5-(difluoromethyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1COc1ccc(cc1Cl)[N+](=O)[O-])/C=N/n1c(S)nnc1C(F)F

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Molecular Weight: 469.86
Empirical Formula: C18H14ClF2N5O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.378
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 146
Number of rings: 3

     

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