COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK695781
Chemical Name: tetraethyl9'-ethoxy-5',5'-dimethyl-6'-(phenylacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Smiles: CCOC(=O)C1=C(C(=O)OCC)C2(C3=C(S1)C(C)(C)N(c1c3cc(OCC)cc1)C(=O)Cc1ccccc1)SC(=C(S2)C(=O)OCC)C(=O)OCC

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Molecular Weight: 767.94
Empirical Formula: C38H41NO10S3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 13.787
Rotatable bonds: 15
H-donors: 0
H-acceptors: 10
PSA: 210
Number of rings: 5

     

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