COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK982725
Chemical Name: (2E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-[5-(4-nitrophenyl)furan-2-yl]prop-2-en-1-one
Smiles: CCCCOc1ccc(cc1)C(=O)/C(=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-])/c1nc2c(o1)cccc2

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Molecular Weight: 508.53
Empirical Formula: C30H24N2O6

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 8.684
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 111
Number of rings: 5

     

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