COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK182711
Chemical Name: 3-(5-{(1E)-3-[(3-bromophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}furan-2-yl)-4-chlorobenzoicacid
Smiles: N#C/C(=C\c1ccc(o1)c1cc(ccc1Cl)C(=O)O)/C(=O)Nc1cccc(c1)Br

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Molecular Weight: 471.69
Empirical Formula: C21H12BrClN2O4

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 6.5
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 103
Number of rings: 3

     

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