COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK593911
Chemical Name: 4-[(E)-(4-iminio-7,8-dimethyl-2-oxo-2H-pyrimido[2,1-b][1,3]benzothiazol-3(4H)-ylidene)methyl]benzoate
Smiles: O=C1N=c2sc3c(n2C(=[NH2+])/C/1=C\c1ccc(cc1)C(=O)[O-])cc(c(c3)C)C

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Molecular Weight: 377.42
Empirical Formula: C20H15N3O3S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 3.881
Rotatable bonds: 0
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 4

     

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