COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK130911
Chemical Name: 3'-ethyl4,5-dimethyl9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4,5-tricarboxylate
Smiles: CCOc1ccc2c(c1)C1=C(C(N2)(C)C)SC(=CC21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OCC

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Molecular Weight: 549.69
Empirical Formula: C25H27NO7S3

Physical State: Dry powder
Available Amount: 404 mg

Lipinsky:
logP: 9.043
Rotatable bonds: 9
H-donors: 1
H-acceptors: 7
PSA: 176
Number of rings: 4

     

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