COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK669948
Chemical Name: 4-[(E)-{2-[3-(benzylsulfanyl)-2-{[(3,5-dinitrophenyl)carbonyl]amino}propanoyl]hydrazinylidene}methyl]phenylacetate(non-preferredname)
Smiles: CC(=O)Oc1ccc(cc1)/C=N/NC(=O)C(NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])CSCc1ccccc1

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Molecular Weight: 565.56
Empirical Formula: C26H23N5O8S

Physical State: Dry powder
Available Amount: 34 mg

Lipinsky:
logP: 5.345
Rotatable bonds: 7
H-donors: 2
H-acceptors: 8
PSA: 213
Number of rings: 3

     

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