COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045470
Chemical Name: tetraethyl5',5',9'-trimethyl-6'-(naphthalen-1-ylcarbonyl)-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(C)cc1)C(=O)c1cccc3c1cccc3)SC(=C(S2)C(=O)OCC)C(=O)OCC

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Molecular Weight: 773.95
Empirical Formula: C40H39NO9S3

Physical State: Dry powder
Available Amount: 446 mg

Lipinsky:
logP: 14.125
Rotatable bonds: 13
H-donors: 0
H-acceptors: 9
PSA: 201
Number of rings: 6

     

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