COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK051896
Chemical Name: (4E)-4-{3-ethoxy-4-[2-(naphthalen-1-ylsulfanyl)ethoxy]benzylidene}-1-phenylpyrazolidine-3,5-dione
Smiles: CCOc1cc(ccc1OCCSc1cccc2c1cccc2)/C=C/1\C(=O)NN(C1=O)c1ccccc1

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Molecular Weight: 510.61
Empirical Formula: C30H26N2O4S

Physical State: Dry powder
Available Amount: 357 mg

Lipinsky:
logP: 7.054
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 93
Number of rings: 5

     

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