COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK781005
Chemical Name: (2Z)-2-[(1R,2R,5S)-2-{4-methyl-3-[(9-oxoacridin-10(9H)-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-preferredname)
Smiles: NC(=S)N/N=C\1/C[C@H]([C@H]2O[C@@H]1OC2)n1nc(n(c1=S)C)Cn1c2ccccc2c(=O)c2c1cccc2

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Molecular Weight: 521.62
Empirical Formula: C24H23N7O3S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.283
Rotatable bonds: 1
H-donors: 3
H-acceptors: 3
PSA: 172
Number of rings: 6

     

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