COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418102
Chemical Name: 4-[(1Z)-3-amino-2-cyano-3-oxoprop-1-en-1-yl]phenyl4-tert-butylbenzoate
Smiles: N#C/C(=C/c1ccc(cc1)OC(=O)c1ccc(cc1)C(C)(C)C)/C(=O)N

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Molecular Weight: 348.4
Empirical Formula: C21H20N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.065
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 93
Number of rings: 2

     

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