COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK190783
Chemical Name: N-{(1E)-3-[(2E)-2-(2,4-dichlorobenzylidene)hydrazinyl]-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl}-4-nitrobenzamide
Smiles: CCN(c1ccc(cc1)/C=C(\C(=O)N/N=C/c1ccc(cc1Cl)Cl)/NC(=O)c1ccc(cc1)[N+](=O)[O-])CC

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Molecular Weight: 554.43
Empirical Formula: C27H25Cl2N5O4

Physical State: Dry powder
Available Amount: 454 mg

Lipinsky:
logP: 8.203
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 119
Number of rings: 3

     

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