COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK789565
Chemical Name: diethyl6'-acetyl-9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
Smiles: CCOc1ccc2c(c1)C1=C(C(N2C(=O)C)(C)C)SC(=CC21SC=C(S2)C(=O)OCC)C(=O)OCC

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Molecular Weight: 547.72
Empirical Formula: C26H29NO6S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.657
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 158
Number of rings: 4

     

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