COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545108
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]methylidene}-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 621.57
Empirical Formula: C26H27N11O8

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 0.573
Rotatable bonds: 7
H-donors: 3
H-acceptors: 8
PSA: 250
Number of rings: 5

     

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