COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051320
Chemical Name: 2-[(1,3-benzoxazol-2-ylsulfanyl)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)CSc1nc2c(o1)cccc2

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Molecular Weight: 479.52
Empirical Formula: C26H17N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.617
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 127
Number of rings: 7

     

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