COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522248
Chemical Name: 1-[5-(naphthalen-1-ylsulfanyl)-3-nitro-1H-1,2,4-triazol-1-yl]propan-2-one
Smiles: CC(=O)Cn1nc(nc1Sc1cccc2c1cccc2)[N+](=O)[O-]

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Molecular Weight: 328.35
Empirical Formula: C15H12N4O3S

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 3.591
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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