COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL238471
Chemical Name: 3-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-3,8,8-trimethyl-2,7-dioxaspiro[4.4]nonane-1,6-dione
Smiles: O=C(C1(C)OC(=O)C2(C1)CC(OC2=O)(C)C)CSc1nc2c(s1)cccc2

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Molecular Weight: 405.5
Empirical Formula: C19H19NO5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.073
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 136
Number of rings: 4

     

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