COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380418
Chemical Name: (2E)-N-methyl-2-{3-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}hydrazinecarbothioamide
Smiles: CNC(=S)N/N=C/c1cccc(c1)Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 398.37
Empirical Formula: C16H13F3N4O3S

Physical State: Dry powder
Available Amount: 830 mg

Lipinsky:
logP: 3.668
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 2

     

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