COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK622209
Chemical Name: ethyl4-{(3E)-2,5-dioxo-3-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]pyrrolidin-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C/C(=C\c2c(C)nn(c2C)C)/C1=O

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Molecular Weight: 367.4
Empirical Formula: C20H21N3O4

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.31
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 81
Number of rings: 3

     

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