COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL134119
Chemical Name: tert-butyl2-(4-tert-butylphenyl)-3-thioxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxylate
Smiles: O=C(N1CCC2(CC1)N=C(C(=S)N2)c1ccc(cc1)C(C)(C)C)OC(C)(C)C

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Molecular Weight: 401.57
Empirical Formula: C22H31N3O2S

Physical State: Dry powder
Available Amount: 2280 mg

Lipinsky:
logP: 4.908
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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