COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL219610
Chemical Name: dimethylN-[(4-nitrophenyl)carbonyl]-beta-alanylaspartate
Smiles: COC(=O)CC(C(=O)OC)NC(=O)CCNC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 381.34
Empirical Formula: C16H19N3O8

Available Amount: 0 mg

Lipinsky:
logP: 0.726
Rotatable bonds: 9
H-donors: 2
H-acceptors: 8
PSA: 156
Number of rings: 1

     

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