COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK107586
Chemical Name: 4-[(4-tert-butylbenzylidene)amino]-5-(2,4-dichlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(c(c1)Cl)c1nnc(n1/N=C/c1ccc(cc1)C(C)(C)C)S

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Molecular Weight: 405.35
Empirical Formula: C19H18Cl2N4S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 7.469
Rotatable bonds: 3
H-donors: 0
H-acceptors: 0
PSA: 81
Number of rings: 3

     

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