COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL245363
Chemical Name: 2-(2-methoxyethyl)-1-oxo-N-[(2E)-5-(tetrahydrofuran-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-1,2-dihydroisoquinoline-4-carboxamide
Smiles: COCCn1cc(C(=O)/N=c/2\[nH]nc(s2)C2CCCO2)c2c(c1=O)cccc2

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Molecular Weight: 400.46
Empirical Formula: C19H20N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.68
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 117
Number of rings: 4

     

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