COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052077
Chemical Name: 4-hydroxy-6-oxo-1-[4-(propan-2-yl)phenyl]-5-(1,2,3,4-tetrahydroisoquinolinium-1-yl)-1,6-dihydropyrimidine-2-thiolate
Smiles: Oc1nc([S-])n(c(=O)c1C1[NH2+]CCc2c1cccc2)c1ccc(cc1)C(C)C

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Molecular Weight: 393.51
Empirical Formula: C22H23N3O2S

Physical State: Dry powder
Available Amount: 318 mg

Lipinsky:
logP: 5.395
Rotatable bonds: 2
H-donors: 3
H-acceptors: 2
PSA: 69
Number of rings: 4

     

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