COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK454712
Chemical Name: (2Z)-2-{3-[(2,3-dihydro-1H-inden-5-yloxy)methyl]-4-methoxybenzylidene}-4,4-dimethyl-3-oxopentanenitrile
Smiles: N#C/C(=C/c1ccc(c(c1)COc1ccc2c(c1)CCC2)OC)/C(=O)C(C)(C)C

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Molecular Weight: 389.49
Empirical Formula: C25H27NO3

Physical State: Dry powder
Available Amount: 630 mg

Lipinsky:
logP: 5.69
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 3

     

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