COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL007608
Chemical Name: (3E)-3-(3,4-dihydroxybenzylidene)-4-imino-8-(methylsulfonyl)-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazol-2-one
Smiles: O=C1N=c2sc3c(n2C(=N)/C/1=C\c1ccc(c(c1)O)O)ccc(c3)S(=O)(=O)C

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Molecular Weight: 415.45
Empirical Formula: C18H13N3O5S2

Available Amount: 0 mg

Lipinsky:
logP: 0.774
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 164
Number of rings: 4

     

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