COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL071017
Chemical Name: 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccc(cc2)C)c2ccc(cc2)Cl)cc(c1OC)OC

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Molecular Weight: 552.05
Empirical Formula: C27H26ClN5O4S

Physical State: Dry powder
Available Amount: 232 mg

Lipinsky:
logP: 8.17
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 125
Number of rings: 4

     

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