COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK506945
Chemical Name: 4-[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-1-yl]benzoicacid
Smiles: O=C(c1ccc2c(c1)OCO2)/C=C/c1ccc(cc1)C(=O)O

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Molecular Weight: 296.28
Empirical Formula: C17H12O5

Physical State: Dry powder
Available Amount: 133 mg

Lipinsky:
logP: 2.905
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 72
Number of rings: 3

     

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