COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056290
Chemical Name: (5Z)-1-(2,5-dimethylphenyl)-4,6-dioxo-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolinium-9-ylmethylidene)-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: Cc1ccc(c(c1)N1C(=NC(=O)/C(=C/c2cc3CCC[NH+]4c3c(c2)CCC4)/C1=O)[S-])C

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Molecular Weight: 431.56
Empirical Formula: C25H25N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.057
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 54
Number of rings: 5

     

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