COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK596904
Chemical Name: 2-hydroxy-4-{(Z)-[4-iminio-8-(methylsulfonyl)-2-oxo-2H-pyrimido[2,1-b][1,3]benzothiazol-3(4H)-ylidene]methyl}phenolate
Smiles: O=C1N=c2sc3c(n2C(=[NH2+])/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

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 0.774
Rotatable bonds: 3
H-donors: 3
H-acceptors: 5
PSA: 169
Number of rings: 4

     

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