COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK780485
Chemical Name: 4-[({4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
Smiles: Nc1nc(CSc2nnc(n2C)Cn2c(C)ncc2[N+](=O)[O-])nc(n1)N1CCCCC1

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Molecular Weight: 445.51
Empirical Formula: C17H23N11O2S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: -0.16
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 187
Number of rings: 4

     

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