COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK981116
Chemical Name: 8,8-dimethyl-2-thioxo-5-(3,4,5-trimethoxyphenyl)-2,3,5,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6(1H,7H)-dione
Smiles: COc1c(OC)cc(cc1OC)C1C2=C(Nc3c1c(=O)[nH]c(=S)[nH]3)CC(CC2=O)(C)C

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Molecular Weight: 443.52
Empirical Formula: C22H25N3O5S

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 1.338
Rotatable bonds: 2
H-donors: 3
H-acceptors: 5
PSA: 130
Number of rings: 4

     

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