COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055113
Chemical Name: 2-(3,4-dimethoxybenzyl)-12-phenyl-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-9-olate
Smiles: COc1ccc(cc1OC)Cc1[nH+]n2c(n1)c1c(nc2)Oc2c(C1c1ccccc1)ccc(c2)[O-]

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Molecular Weight: 466.5
Empirical Formula: C27H22N4O4

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 3.353
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 6

     

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