COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK085758
Chemical Name: 2-(4-chlorobenzyl)-4-[(4-nitrophenyl)amino]-4-oxobutanoicacid
Smiles: O=C(CC(C(=O)O)Cc1ccc(cc1)Cl)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 362.77
Empirical Formula: C17H15ClN2O5

Physical State: Dry powder
Available Amount: 397 mg

Lipinsky:
logP: 4.171
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 112
Number of rings: 2

     

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