COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK573892
Chemical Name: (4E)-2-(1,3-benzodioxol-5-yl)-4-{[(3-hydroxyphenyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: Oc1cccc(c1)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc2c(c1)OCO2

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Molecular Weight: 400.39
Empirical Formula: C23H16N2O5

Physical State: Dry powder
Available Amount: 252 mg

Lipinsky:
logP: 3.343
Rotatable bonds: 1
H-donors: 2
H-acceptors: 5
PSA: 88
Number of rings: 5

     

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