COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK079960
Chemical Name: 5-methyl-2-(propan-2-yl)phenyl4-nitrobenzoate
Smiles: Cc1ccc(c(c1)OC(=O)c1ccc(cc1)[N+](=O)[O-])C(C)C

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Molecular Weight: 299.33
Empirical Formula: C17H17NO4

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 5.35
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 72
Number of rings: 2

     

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