COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK716337
Chemical Name: 4-tert-butyl-N-{(1Z)-1-[2-(butylamino)-1-cyano-2-oxoethylidene]-1H-isoindol-3-yl}benzamide
Smiles: CCCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C(C)(C)C)/C#N

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Molecular Weight: 428.53
Empirical Formula: C26H28N4O2

Physical State: Dry powder
Available Amount: 364 mg

Lipinsky:
logP: 4.069
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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