COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK087081
Chemical Name: tetraethyl9'-ethoxy-5',5'-dimethyl-6'-propanoyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Smiles: CCOc1ccc2c(c1)C1=C(C(N2C(=O)CC)(C)C)SC(=C(C21SC(=C(S2)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC

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Molecular Weight: 705.87
Empirical Formula: C33H39NO10S3

Physical State: Dry powder
Available Amount: 453 mg

Lipinsky:
logP: 12.53
Rotatable bonds: 15
H-donors: 0
H-acceptors: 10
PSA: 210
Number of rings: 4

     

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