COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK752944
Chemical Name: (4Z)-4-(3-bromobenzylidene)-2-(2-chloro-5-nitrophenyl)-1,3-oxazol-5(4H)-one
Smiles: Brc1cccc(c1)/C=C/1\N=C(OC1=O)c1cc(ccc1Cl)[N+](=O)[O-]

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Molecular Weight: 407.61
Empirical Formula: C16H8BrClN2O4

Physical State: Dry powder
Available Amount: 5 mg

Lipinsky:
logP: 5.096
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 84
Number of rings: 3

     

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