COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455734
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carbothioamide
Smiles: COc1cc(CCNC(=S)N2CCC3(CC2)OCCO3)ccc1OC

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Molecular Weight: 366.48
Empirical Formula: C18H26N2O4S

Physical State: Dry powder
Available Amount: 477 mg

Lipinsky:
logP: 1.749
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 84
Number of rings: 3

     

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