COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567200
Chemical Name: 2-(4-methoxybenzyl)-12-(4-methoxyphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-9-olate
Smiles: COc1ccc(cc1)Cc1[nH+]n2c(n1)c1c(nc2)Oc2c(C1c1ccc(cc1)OC)ccc(c2)[O-]

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Molecular Weight: 466.5
Empirical Formula: C27H22N4O4

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 3.447
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 6

     

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