COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK774838
Chemical Name: (2Z)-2-{(1R,2R,5S)-2-[4-(3-methoxyphenyl)-5-thioxo-4,5-dihydro-1H-tetrazol-1-yl]-6,8-dioxabicyclo[3.2.1]oct-4-ylidene}hydrazinecarbothioamide(non-preferredname)
Smiles: COc1cccc(c1)n1nnn(c1=S)[C@@H]1C/C(=N/NC(=S)N)/[C@@H]2O[C@H]1CO2

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Molecular Weight: 407.48
Empirical Formula: C15H17N7O3S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -0.278
Rotatable bonds: 1
H-donors: 3
H-acceptors: 3
PSA: 173
Number of rings: 4

     

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