COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045470
Chemical Name: 4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-2-ethoxyphenyl4-fluorobenzoate
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CSC2=NCCS2)c2nonc2N)ccc1OC(=O)c1ccc(cc1)F

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Molecular Weight: 611.64
Empirical Formula: C25H22FN9O5S2

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 1.914
Rotatable bonds: 10
H-donors: 3
H-acceptors: 5
PSA: 235
Number of rings: 5

     

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