COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL568468
Chemical Name: methyl{1-[2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-4-(methylsulfanyl)butanoyl]piperidin-4-yl}acetate
Smiles: CSCCC(n1c(O)nc2c(c1=O)cccc2)C(=O)N1CCC(CC1)CC(=O)OC

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Molecular Weight: 433.53
Empirical Formula: C21H27N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.12
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 124
Number of rings: 3

     

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