COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034236
Chemical Name: 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(3,4-dimethoxyphenyl)ethylidene]acetohydrazide
Smiles: COc1ccc(cc1OC)/C(=N/NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl)/C

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Molecular Weight: 536.05
Empirical Formula: C27H26ClN5O3S

Physical State: Dry powder
Available Amount: 408 mg

Lipinsky:
logP: 7.668
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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