COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK760698
Chemical Name: 4,8-dioxo-5-(3,4,5-trimethoxyphenyl)-1,3,4,5,7,8,9,10,11,12-decahydro-2H-[1]benzothieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: COc1cc(cc(c1OC)OC)C1C2=C(CCCC2=O)n2c(=C1C#N)[nH]c(=O)c1c2sc2c1CCCC2

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Molecular Weight: 517.61
Empirical Formula: C28H27N3O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.702
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 6

     

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