COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL514228
Chemical Name: 3-(1,3-benzothiazol-2-yl)-2-methyl-8-(morpholin-4-ium-4-ylmethyl)-4-oxo-4H-chromen-7-olate
Smiles: Cc1oc2c(C[NH+]3CCOCC3)c([O-])ccc2c(=O)c1c1nc2c(s1)cccc2

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Molecular Weight: 408.48
Empirical Formula: C22H20N2O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.869
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 5

     

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