COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL018130
Chemical Name: 3-(4-chlorophenyl)-N-(2-methoxy-4-nitrophenyl)-1-oxo-3,4-dihydro-1H-isochromene-6-carboxamide
Smiles: COc1cc(ccc1NC(=O)c1ccc2c(c1)CC(OC2=O)c1ccc(cc1)Cl)[N+](=O)[O-]

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Molecular Weight: 452.85
Empirical Formula: C23H17ClN2O6

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.526
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 110
Number of rings: 4

     

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