COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK123397
Chemical Name: 2-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one
Smiles: CCOc1cc2c(cc1OCC)CC(=O)N(C2c1ccc(c(c1)OC)OC)c1ccc(cc1)Cl

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Molecular Weight: 481.98
Empirical Formula: C27H28ClNO5

Physical State: Dry powder
Available Amount: 436 mg

Lipinsky:
logP: 5.545
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 4

     

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