COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK056002
Chemical Name: tetramethyl6'-[(3-chloro-1-benzothiophen-2-yl)carbonyl]-9'-methoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Smiles: COc1ccc2c(c1)C1=C(C(N2C(=O)c2sc3c(c2Cl)cccc3)(C)C)SC(=C(C21SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC

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Molecular Weight: 774.31
Empirical Formula: C34H28ClNO10S4

Physical State: Dry powder
Available Amount: 459 mg

Lipinsky:
logP: 12.444
Rotatable bonds: 10
H-donors: 0
H-acceptors: 10
PSA: 238
Number of rings: 6

     

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