COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK092541
Chemical Name: tetramethyl5',5',8'-trimethyl-6'-(naphthalen-1-ylacetyl)-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Smiles: COC(=O)C1=C(C(=O)OC)C2(C3=C(S1)C(C)(C)N(c1c3ccc(c1)C)C(=O)Cc1cccc3c1cccc3)SC(=C(S2)C(=O)OC)C(=O)OC

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Molecular Weight: 731.87
Empirical Formula: C37H33NO9S3

Physical State: Dry powder
Available Amount: 456 mg

Lipinsky:
logP: 12.946
Rotatable bonds: 10
H-donors: 0
H-acceptors: 9
PSA: 201
Number of rings: 6

     

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