COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK220192
Chemical Name: (4Z)-4-{4-[(4-chlorobenzyl)oxy]-3-ethoxy-5-(prop-2-en-1-yl)benzylidene}-1-phenylpyrazolidine-3,5-dione
Smiles: CCOc1cc(/C=C\2/C(=O)NN(C2=O)c2ccccc2)cc(c1OCc1ccc(cc1)Cl)CC=C

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Molecular Weight: 488.97
Empirical Formula: C28H25ClN2O4

Physical State: Dry powder
Available Amount: 358 mg

Lipinsky:
logP: 6.8
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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