COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL019292
Chemical Name: 6-[(E)-2-(3-nitrophenyl)ethenyl]-3-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: [O-][N+](=O)c1cccc(c1)/C=C/c1nn2c(s1)nnc2COc1ccccc1

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Molecular Weight: 379.4
Empirical Formula: C18H13N5O3S

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 4.773
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 126
Number of rings: 4

     

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