COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK298487
Chemical Name: methyl4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)Cn1cnc(n1)[N+](=O)[O-]

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Molecular Weight: 262.22
Empirical Formula: C11H10N4O4

Physical State: Dry powder
Available Amount: 5055 mg

Lipinsky:
logP: 1.033
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 102
Number of rings: 2

     

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