COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186970
Chemical Name: 2-fluoro-N-[2-(4-methyl-5-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CSc1nnc(n1C)CCNC(=O)c1ccccc1F

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Molecular Weight: 443.46
Empirical Formula: C20H18FN5O4S

Physical State: Dry powder
Available Amount: 186 mg

Lipinsky:
logP: 2.56
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 148
Number of rings: 3

     

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