COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL235975
Chemical Name: (6Z)-6-[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxybenzylidene]-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OCc1ccc2c(c1)OCO2)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1

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Molecular Weight: 547.59
Empirical Formula: C27H25N5O6S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.278
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 151
Number of rings: 6

     

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