COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK716332
Chemical Name: 4-tert-butyl-N-{(1Z)-1-[1-cyano-2-(cyclopentylamino)-2-oxoethylidene]-1H-isoindol-3-yl}benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C(C)(C)C)/C(=O)NC1CCCC1

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Molecular Weight: 440.55
Empirical Formula: C27H28N4O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.97
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 94
Number of rings: 4

     

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