COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL445768
Chemical Name: 1-{2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]-4,5-dimethoxybenzyl}-6,7-dimethoxyisoquinoline
Smiles: COc1cc(/N=N/N(C)C)c(cc1OC)Cc1nccc2c1cc(OC)c(c2)OC

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Molecular Weight: 410.47
Empirical Formula: C22H26N4O4

Physical State: Dry powder
Available Amount: 1095 mg

Lipinsky:
logP: 4.793
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 77
Number of rings: 3

     

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