COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL514037
Chemical Name: 3-(1,3-benzothiazol-2-yl)-2-methyl-4-oxo-8-(pyrrolidinium-1-ylmethyl)-4H-chromen-7-olate
Smiles: Cc1oc2c(C[NH+]3CCCC3)c([O-])ccc2c(=O)c1c1nc2c(s1)cccc2

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Molecular Weight: 392.48
Empirical Formula: C22H20N2O3S

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 3.884
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 5

     

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