COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171888
Chemical Name: N-{(1E)-3-[(2E)-2-(4-bromo-3-nitrobenzylidene)hydrazinyl]-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl}benzamide
Smiles: CCN(c1ccc(cc1)/C=C(\C(=O)N/N=C/c1ccc(c(c1)[N+](=O)[O-])Br)/NC(=O)c1ccccc1)CC

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Molecular Weight: 564.44
Empirical Formula: C27H26BrN5O4

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 7.426
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 119
Number of rings: 3

     

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