COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839182
Chemical Name: methyl4-{(Z)-[2-(2-chloro-4-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\N=C(OC1=O)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 386.75
Empirical Formula: C18H11ClN2O6

Physical State: Dry powder
Available Amount: 295 mg

Lipinsky:
logP: 4.279
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 110
Number of rings: 3

     

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