COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK369204
Chemical Name: (1Z)-3-methoxy-1-{[(4-nitrophenyl)carbonyl]amino}-3-oxo-2-(triphenylphosphonio)prop-1-ene-1-thiolate
Smiles: COC(=O)/C(=C(\NC(=O)c1ccc(cc1)[N+](=O)[O-])/[S-])/[P+](c1ccccc1)(c1ccccc1)c1ccccc1

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Molecular Weight: 542.55
Empirical Formula: C29H23N2O5PS

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 0
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 4

     

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