COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL111993
Chemical Name: 3-(4-chlorophenyl)-N-(2-methyl-4-nitrophenyl)-1-oxo-3,4-dihydro-1H-isochromene-6-carboxamide
Smiles: Clc1ccc(cc1)C1OC(=O)c2c(C1)cc(cc2)C(=O)Nc1ccc(cc1C)[N+](=O)[O-]

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Molecular Weight: 436.85
Empirical Formula: C23H17ClN2O5

Physical State: Dry powder
Available Amount: 27 mg

Lipinsky:
logP: 4.785
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 4

     

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