COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL160958
Chemical Name: 2-(2-chlorobenzyl)-N-[(2Z)-5-cyclobutyl-1,3,4-thiadiazol-2(3H)-ylidene]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Smiles: O=C(c1ccc2c(c1)C(=O)N(C2=O)Cc1ccccc1Cl)/N=c\1/[nH]nc(s1)C1CCC1

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Molecular Weight: 452.92
Empirical Formula: C22H17ClN4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.736
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 5

     

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