COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147525
Chemical Name: 2-{[4-(4-methoxyphenyl)-5-oxo-7-(propan-2-yl)-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-2-ium-1-yl]sulfanyl}propanoate
Smiles: COc1ccc(cc1)n1c(=O)c2c3CC(OCc3sc2n2c1n[nH+]c2SC(C(=O)[O-])C)C(C)C

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Molecular Weight: 500.6
Empirical Formula: C23H24N4O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.892
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 164
Number of rings: 5

     

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