COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL158347
Chemical Name: 2-(4-chlorobenzyl)-N-[(2Z)-5-cyclobutyl-1,3,4-thiadiazol-2(3H)-ylidene]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Smiles: Clc1ccc(cc1)CN1C(=O)c2c(C1=O)cc(cc2)C(=O)/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: 3
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 5

     

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