COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK918640
Chemical Name: methyl4-[4,6-dioxo-2-(prop-2-en-1-ylsulfanyl)-3,4,5,6,7,8,9,10-octahydropyrimido[4,5-b]quinolin-5-yl]benzoate
Smiles: C=CCSc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccc(cc1)C(=O)OC)C(=O)CCC3

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Molecular Weight: 423.49
Empirical Formula: C22H21N3O4S

Physical State: Dry powder
Available Amount: 113 mg

Lipinsky:
logP: 2.213
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 4

     

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