COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK063446
Chemical Name: (4Z)-4-(3-bromo-5-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-1-phenylpyrazolidine-3,5-dione
Smiles: C=CCc1ccccc1OCCOc1c(Br)cc(cc1OC)/C=C\1/C(=O)NN(C1=O)c1ccccc1

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Molecular Weight: 549.42
Empirical Formula: C28H25BrN2O5

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.447
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 4

     

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