COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK175331
Chemical Name: (2E)-2-{3-bromo-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}-N-ethylhydrazinecarbothioamide
Smiles: CCNC(=S)N/N=C/c1ccc(c(c1)Br)Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 491.29
Empirical Formula: C17H14BrF3N4O3S

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 5.172
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 2

     

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