COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK091304
Chemical Name: 4-{3-[(2-tert-butyl-2-methyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoicacid
Smiles: O=C1OC(C)(OC(=O)/C/1=C\c1cc(n(c1C)c1ccc(cc1)C(=O)O)C)C(C)(C)C

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Molecular Weight: 411.45
Empirical Formula: C23H25NO6

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 3.553
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 94
Number of rings: 3

     

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