COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL065294
Chemical Name: 3-phenylpropyl5-[({2-[(4-nitrophenyl)carbonyl]hydrazinyl}carbonothioyl)amino]-5-oxopentanoate
Smiles: O=C(NC(=S)NNC(=O)c1ccc(cc1)[N+](=O)[O-])CCCC(=O)OCCCc1ccccc1

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Molecular Weight: 472.52
Empirical Formula: C22H24N4O6S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 3.641
Rotatable bonds: 9
H-donors: 3
H-acceptors: 6
PSA: 174
Number of rings: 2

     

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