COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL424183
Chemical Name: N-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1H-1,2,4-triazol-5-yl}-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Smiles: COc1cc(CCc2n[nH]c(n2)NC(=O)c2cn(C)c(=O)c3c2cccc3)ccc1OC

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Molecular Weight: 433.47
Empirical Formula: C23H23N5O4

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 2.537
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 109
Number of rings: 4

     

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