COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK958801
Chemical Name: 4-{(E)-[2-(2-chloro-4-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-methoxyphenyl2-methylpropanoate
Smiles: COc1cc(ccc1OC(=O)C(C)C)/C=C\1/N=C(OC1=O)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 444.83
Empirical Formula: C21H17ClN2O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.502
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 120
Number of rings: 3

     

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