COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK439274
Chemical Name: (2E)-3-(4-tert-butylphenyl)-N-(2-chloro-4-nitrophenyl)prop-2-enamide
Smiles: O=C(Nc1ccc(cc1Cl)[N+](=O)[O-])/C=C/c1ccc(cc1)C(C)(C)C

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Molecular Weight: 358.82
Empirical Formula: C19H19ClN2O3

Physical State: Dry powder
Available Amount: 474 mg

Lipinsky:
logP: 6.482
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 74
Number of rings: 2

     

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