COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK782397
Chemical Name: (2Z)-2-{(1S,2S,5R)-2-[4-(4-iodophenyl)-5-thioxo-4,5-dihydro-1H-tetrazol-1-yl]-6,8-dioxabicyclo[3.2.1]oct-4-ylidene}hydrazinecarbothioamide(non-preferredname)
Smiles: NC(=S)N/N=C\1/C[C@@H]([C@@H]2O[C@H]1OC2)n1nnn(c1=S)c1ccc(cc1)I

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Molecular Weight: 503.35
Empirical Formula: C14H14IN7O2S2

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 0.838
Rotatable bonds: 0
H-donors: 3
H-acceptors: 2
PSA: 164
Number of rings: 4

     

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