COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK000418
Chemical Name: (4E)-4-{3-chloro-5-methoxy-4-[(2-methylbenzyl)oxy]benzylidene}-1-phenylpyrazolidine-3,5-dione
Smiles: COc1cc(cc(c1OCc1ccccc1C)Cl)/C=C/1\C(=O)NN(C1=O)c1ccccc1

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Molecular Weight: 448.91
Empirical Formula: C25H21ClN2O4

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 5.903
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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