COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056942
Chemical Name: ethyl7-acetyl-8-methyl-1-(4-nitrophenyl)-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3-carboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)SC(=C(N2c1ccccc1)C)C(=O)C)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 484.56
Empirical Formula: C22H20N4O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.307
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 158
Number of rings: 4

     

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