COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK102653
Chemical Name: N'-[(E)-(5-bromo-2-methoxyphenyl)methylidene]-2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2cc(Br)ccc2OC)nnc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 608.56
Empirical Formula: C29H30BrN5O3S

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 9.516
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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