COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK772426
Chemical Name: 3-tert-butyl-7-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CSc1nn2c(s1)nnc(c2=O)C(C)(C)C

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Molecular Weight: 405.46
Empirical Formula: C16H15N5O4S2

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 1.441
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 170
Number of rings: 3

     

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