COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK190779
Chemical Name: 3-bromo-N-{(1Z)-1-[4-(dimethylamino)phenyl]-3-[(2E)-2-(2-nitrobenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide
Smiles: Brc1cccc(c1)C(=O)N/C(=C\c1ccc(cc1)N(C)C)/C(=O)N/N=C/c1ccccc1[N+](=O)[O-]

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Molecular Weight: 536.39
Empirical Formula: C25H22BrN5O4

Physical State: Dry powder
Available Amount: 470 mg

Lipinsky:
logP: 6.794
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 119
Number of rings: 3

     

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