COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK070931
Chemical Name: 2-chloro-N-{(1E)-1-[4-(diethylamino)phenyl]-3-[(2E)-2-(5-hydroxy-2-nitrobenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide
Smiles: CCN(c1ccc(cc1)/C=C(\C(=O)N/N=C/c1cc(O)ccc1[N+](=O)[O-])/NC(=O)c1ccccc1Cl)CC

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Molecular Weight: 535.99
Empirical Formula: C27H26ClN5O5

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 7.027
Rotatable bonds: 6
H-donors: 3
H-acceptors: 5
PSA: 139
Number of rings: 3

     

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