COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK918769
Chemical Name: 8,8-dimethyl-2-[(3-methylbutyl)sulfanyl]-5-(thiophen-2-yl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Smiles: CC(CCSc1nc2NC3=C(C(c2c(=O)[nH]1)c1cccs1)C(=O)CC(C3)(C)C)C

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Molecular Weight: 429.61
Empirical Formula: C22H27N3O2S2

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 4.061
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 124
Number of rings: 4

     

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