COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL217645
Chemical Name: methylN-[(4-nitrophenyl)carbonyl]-beta-alanyl-beta-alaninate
Smiles: COC(=O)CCNC(=O)CCNC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 323.31
Empirical Formula: C14H17N3O6

Available Amount: 0 mg

Lipinsky:
logP: 0.331
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 130
Number of rings: 1

     

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