COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681966
Chemical Name: 5-methoxy-2-(6'-methoxy-1',3',4',9a'-tetrahydrospiro[cyclohexane-1,9'-xanthen]-4a'(2'H)-yl)phenylthiophene-2-sulfonate
Smiles: COc1ccc(c(c1)OS(=O)(=O)c1cccs1)C12CCCCC2C2(c3c(O1)cc(OC)cc3)CCCCC2

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Molecular Weight: 554.73
Empirical Formula: C30H34O6S2

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 8.174
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 107
Number of rings: 6

     

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