COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK586420
Chemical Name: (2E)-N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-2-cyano-3-(6-hydroxy-4-oxo-4H-chromen-3-yl)prop-2-enamide
Smiles: N#C/C(=C\c1coc2c(c1=O)cc(cc2)O)/C(=O)/N=c\1/sc2c([nH]1)cccc2

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Molecular Weight: 389.39
Empirical Formula: C20H11N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.157
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 137
Number of rings: 4

     

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