COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK316479
Chemical Name: 1-ethyl-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-4-nitro-1H-pyrazole-5-carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C)[N+](=O)[O-]

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Molecular Weight: 395.42
Empirical Formula: C14H13N5O5S2

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 0.197
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 176
Number of rings: 3

     

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