COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL558113
Chemical Name: 1-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-3-(4-methylphenyl)urea
Smiles: COc1cc(NC(=O)Nc2ccc(cc2)C)c(cc1OC)Cc1nccc2c1cc(OC)c(c2)OC

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Molecular Weight: 487.56
Empirical Formula: C28H29N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.221
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 90
Number of rings: 4

     

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