COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK071651
Chemical Name: tetramethyl7'-methoxy-6'-[(3-methoxyphenyl)carbonyl]-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Smiles: COc1cccc(c1)C(=O)N1c2c(OC)cccc2C2=C(C1(C)C)SC(=C(C12SC(=C(S1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC

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Molecular Weight: 713.81
Empirical Formula: C33H31NO11S3

Physical State: Dry powder
Available Amount: 554 mg

Lipinsky:
logP: 10.45
Rotatable bonds: 11
H-donors: 0
H-acceptors: 11
PSA: 219
Number of rings: 5

     

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