COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL513109
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-2-({[4-(2-methylpropoxy)phenyl]carbonyl}amino)prop-2-enoicacid
Smiles: CC(COc1ccc(cc1)C(=O)N/C(=C/c1ccc2c(c1)OCO2)/C(=O)O)C

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Molecular Weight: 383.4
Empirical Formula: C21H21NO6

Physical State: Dry powder
Available Amount: 290 mg

Lipinsky:
logP: 4.373
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 94
Number of rings: 3

     

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