COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK006102
Chemical Name: (2E)-2-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-chloro-5-methoxybenzylidene}-N-phenylhydrazinecarbothioamide
Smiles: COc1cc(/C=N/NC(=S)Nc2ccccc2)cc(c1OCCOc1ccc(cc1)C(C)(C)C)Cl

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Molecular Weight: 512.07
Empirical Formula: C27H30ClN3O3S

Physical State: Dry powder
Available Amount: 167 mg

Lipinsky:
logP: 8.797
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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