COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552674
Chemical Name: dibenzylN~2~-[(benzyloxy)carbonyl]-N~5~-(N'-nitrocarbamimidoyl)-D-ornithylglycyl-D-aspartate
Smiles: [O-][N+](=O)/N=C(\NCCC[C@H](C(=O)NCC(=O)N[C@@H](C(=O)OCc1ccccc1)CC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1)/N

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Molecular Weight: 705.72
Empirical Formula: C34H39N7O10

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 4.96
Rotatable bonds: 16
H-donors: 6
H-acceptors: 10
PSA: 245
Number of rings: 3

     

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