COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK190767
Chemical Name: N-{(1Z)-3-[(2E)-2-(3-bromo-2-hydroxy-5-nitrobenzylidene)hydrazinyl]-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}-3-fluorobenzamide
Smiles: Fc1cccc(c1)C(=O)N/C(=C\c1ccc(cc1)N(C)C)/C(=O)N/N=C/c1cc(cc(c1O)Br)[N+](=O)[O-]

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Molecular Weight: 570.37
Empirical Formula: C25H21BrFN5O5

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 7.203
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 139
Number of rings: 3

     

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