COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK590885
Chemical Name: (4E)-2-(5-chloro-2-methylphenyl)-4-{[(pyridin-2-ylmethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: Clc1ccc(c(c1)N1C(=O)/C(=C/NCc2ccccn2)/c2c(C1=O)cccc2)C

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Molecular Weight: 403.87
Empirical Formula: C23H18ClN3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.898
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 62
Number of rings: 4

     

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