COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK078398
Chemical Name: tetramethyl6'-butanoyl-5',5',9'-trimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Smiles: CCCC(=O)N1c2ccc(cc2C2=C(C1(C)C)SC(=C(C12SC(=C(S1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)C

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Molecular Weight: 633.76
Empirical Formula: C29H31NO9S3

Physical State: Dry powder
Available Amount: 570 mg

Lipinsky:
logP: 10.989
Rotatable bonds: 10
H-donors: 0
H-acceptors: 9
PSA: 201
Number of rings: 4

     

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