COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK555521
Chemical Name: methyl(3Z)-3-[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]-2-oxo-2,3-dihydro-1H-indole-1-carboxylate
Smiles: COC(=O)N1C(=O)/C(=N\NC(=O)c2nnn(c2CSC2=NCCS2)c2nonc2N)/c2c1cccc2

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Molecular Weight: 528.53
Empirical Formula: C19H16N10O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.681
Rotatable bonds: 6
H-donors: 3
H-acceptors: 5
PSA: 246
Number of rings: 5

     

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