COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK153991
Chemical Name: 4-{(1E)-2-cyano-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-1-yl}phenyl2,4-dichlorobenzoate
Smiles: N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1Cl)Cl)/C(=O)NCc1ccco1

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Molecular Weight: 441.27
Empirical Formula: C22H14Cl2N2O4

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 4.58
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 92
Number of rings: 3

     

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