COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL562847
Chemical Name: methylN-[(13E,15R)-15-hydroxy-1,9-dioxoprost-13-en-1-yl]-O-methyl-3-nitrotyrosinate
Smiles: CCCCC[C@H](/C=C/[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)NC(C(=O)OC)Cc1ccc(c(c1)[N+](=O)[O-])OC)O

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Molecular Weight: 574.71
Empirical Formula: C31H46N2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.663
Rotatable bonds: 17
H-donors: 2
H-acceptors: 8
PSA: 147
Number of rings: 2

     

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