COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK031170
Chemical Name: 4-{[(E)-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-chloro-5-ethoxyphenyl}methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CCOc1cc(/C=N/c2c(=O)n(n(c2C)C)c2ccccc2)cc(c1OCCOc1ccc(cc1)C(C)(C)C)Cl

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Molecular Weight: 562.11
Empirical Formula: C32H36ClN3O4

Physical State: Dry powder
Available Amount: 338 mg

Lipinsky:
logP: 7.282
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 63
Number of rings: 4

     

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