COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK046778
Chemical Name: 2-chloro-N-{(1E)-1-[4-(dimethylamino)phenyl]-3-[(2E)-2-(2-hydroxy-3-methyl-5-nitrobenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide
Smiles: O=C(/C(=C\c1ccc(cc1)N(C)C)/NC(=O)c1ccccc1Cl)N/N=C/c1cc(cc(c1O)C)[N+](=O)[O-]

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Molecular Weight: 521.96
Empirical Formula: C26H24ClN5O5

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 6.591
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 139
Number of rings: 3

     

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