COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL015381
Chemical Name: ethyl4-[1-(4-chlorophenyl)-6,7-diethoxy-3-oxo-3,4-dihydroisoquinolin-2(1H)-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)Cc2c(C1c1ccc(cc1)Cl)cc(c(c2)OCC)OCC

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Molecular Weight: 493.99
Empirical Formula: C28H28ClNO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.317
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 65
Number of rings: 4

     

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