COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK311826
Chemical Name: N-(1-benzyl-1H-pyrazol-3-yl)-5-{1-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}-1,3,4-thiadiazol-2-amine
Smiles: [O-][N+](=O)c1c(C)nn(c1C)Cn1ccc(n1)c1nnc(s1)Nc1ccn(n1)Cc1ccccc1

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Molecular Weight: 476.52
Empirical Formula: C21H20N10O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.384
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 165
Number of rings: 5

     

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