COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK043530
Chemical Name: tetramethyl6'-[(2E)-but-2-enoyl]-9'-methoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Smiles: C/C=C/C(=O)N1c2ccc(cc2C2=C(C1(C)C)SC(=C(C12SC(=C(S1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)OC

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Molecular Weight: 647.75
Empirical Formula: C29H29NO10S3

Physical State: Dry powder
Available Amount: 460 mg

Lipinsky:
logP: 9.797
Rotatable bonds: 10
H-donors: 0
H-acceptors: 10
PSA: 210
Number of rings: 4

     

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