COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL324106
Chemical Name: 5-(ethylsulfanyl)-2-(iodomethyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e][1,3]oxazolo[3,2-c]pyrimidin-4-ium
Smiles: CCSc1nc2sc3c(c2c2[n+]1CC(O2)CI)CCCC3

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Saltdata: I-
Molecular Weight: 433.36
Empirical Formula: C15H18IN2OS2

Physical State: Dry powder
Available Amount: 243 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 79
Number of rings: 4

     

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