COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL006488
Chemical Name: methyl3-acetyl-8-methyl-1-(3-nitrophenyl)-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-7-carboxylate
Smiles: COC(=O)C1=C(C)N(C2(S1)SC(=NN2c1cccc(c1)[N+](=O)[O-])C(=O)C)c1ccccc1

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Molecular Weight: 470.53
Empirical Formula: C21H18N4O5S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.328
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 158
Number of rings: 4

     

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