COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK597789
Chemical Name: (4E)-2-(2,4-dimethoxyphenyl)-4-{[(2-hydroxyethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: OCCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1OC)OC

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Molecular Weight: 368.39
Empirical Formula: C20H20N2O5

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 1.924
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 88
Number of rings: 3

     

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