COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK644196
Chemical Name: (4E)-5-(3,4-dichlorophenyl)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)(hydroxy)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Smiles: O=C1C(=O)N(C(/C/1=C(/c1c(C)n[nH]c1C)\O)c1ccc(c(c1)Cl)Cl)Cc1cccnc1

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Molecular Weight: 457.32
Empirical Formula: C22H18Cl2N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.481
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 99
Number of rings: 4

     

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