COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434352
Chemical Name: (2Z)-4,4-dimethyl-3-oxo-2-(2,4,6-trimethylbenzylidene)pentanenitrile
Smiles: N#C/C(=C/c1c(C)cc(cc1C)C)/C(=O)C(C)(C)C

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Molecular Weight: 255.36
Empirical Formula: C17H21NO

Physical State: Dry powder
Available Amount: 638 mg

Lipinsky:
logP: 4.433
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 40
Number of rings: 1

     

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