COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040952
Chemical Name: 2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-12-phenyl-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-9-olate
Smiles: [O-]c1ccc2c(c1)Oc1c(C2c2ccccc2)c2nc([nH+]n2cn1)COc1cc(C)ccc1C(C)C

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Molecular Weight: 478.55
Empirical Formula: C29H26N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.255
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 85
Number of rings: 6

     

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