COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK059915
Chemical Name: (3E)-3-(2-chloro-5-nitrobenzylidene)-5-(4-methylphenyl)furan-2(3H)-one
Smiles: Cc1ccc(cc1)C1=C/C(=C\c2cc(ccc2Cl)[N+](=O)[O-])/C(=O)O1

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Molecular Weight: 341.75
Empirical Formula: C18H12ClNO4

Physical State: Dry powder
Available Amount: 346 mg

Lipinsky:
logP: 4.945
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 72
Number of rings: 3

     

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