COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL246340
Chemical Name: 2-(2-methylpropyl)-1-oxo-N-[(2E)-5-(tetrahydrofuran-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-1,2-dihydroisoquinoline-4-carboxamide
Smiles: CC(Cn1cc(C(=O)/N=c/2\[nH]nc(s2)C2CCCO2)c2c(c1=O)cccc2)C

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Molecular Weight: 398.49
Empirical Formula: C20H22N4O3S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.08
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 108
Number of rings: 4

     

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