COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL242108
Chemical Name: 2-(3-methylbutyl)-1-oxo-N-[(2E)-1,3,4-thiadiazol-2(3H)-ylidene]-1,2-dihydroisoquinoline-4-carboxamide
Smiles: CC(CCn1cc(C(=O)/N=c\2/scn[nH]2)c2c(c1=O)cccc2)C

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Molecular Weight: 342.42
Empirical Formula: C17H18N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.042
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 99
Number of rings: 3

     

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