COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039457
Chemical Name: 2-methoxy-6-[(E)-{[3-(methoxycarbonyl)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl]imino}methyl]phenolate
Smiles: COC(=O)c1c(/N=C/c2cccc(c2[O-])OC)sc2c1CC[NH+](C2)C

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Molecular Weight: 360.43
Empirical Formula: C18H20N2O4S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 3.246
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 3

     

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