COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK104019
Chemical Name: 4-[(4-tert-butylbenzylidene)amino]-5-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)c1nnc(n1/N=C\c1ccc(cc1)C(C)(C)C)S

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Molecular Weight: 370.91
Empirical Formula: C19H19ClN4S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 7.284
Rotatable bonds: 2
H-donors: 0
H-acceptors: 0
PSA: 81
Number of rings: 3

     

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