COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL008668
Chemical Name: methyl4-[(1E)-2-(1,3-benzoxazol-2-yl)-3-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-1-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C(/C(=O)c1ccc(c(c1)OC)OC)\c1nc2c(o1)cccc2

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Molecular Weight: 443.46
Empirical Formula: C26H21NO6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.113
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 87
Number of rings: 4

     

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