COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK105867
Chemical Name: 2,4-dibromo-6-[(E)-{[3-(4-tert-butylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]phenol
Smiles: Brc1cc(/C=N/n2c(S)nnc2c2ccc(cc2)C(C)(C)C)c(c(c1)Br)O

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Molecular Weight: 510.25
Empirical Formula: C19H18Br2N4OS

Physical State: Dry powder
Available Amount: 111 mg

Lipinsky:
logP: 8.837
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 102
Number of rings: 3

     

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