COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK780787
Chemical Name: (2Z)-2-[(1S,2S,5R)-2-(4-ethyl-3-{[5-(4-methylphenyl)-2H-tetrazol-2-yl]methyl}-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]oct-4-ylidene]hydrazinecarbothioamide(non-preferredna
Smiles: CCn1c(Cn2nnc(n2)c2ccc(cc2)C)nn(c1=S)[C@H]1C/C(=N/NC(=S)N)/[C@H]2O[C@@H]1CO2

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Molecular Weight: 500.61
Empirical Formula: C20H24N10O2S2

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 0.288
Rotatable bonds: 3
H-donors: 3
H-acceptors: 2
PSA: 195
Number of rings: 5

     

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