COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK006915
Chemical Name: 2-({(2E)-3-[5-(3-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoyl}amino)benzoicacid
Smiles: N#C/C(=C\c1ccc(o1)c1cccc(c1)Cl)/C(=O)Nc1ccccc1C(=O)O

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Molecular Weight: 392.8
Empirical Formula: C21H13ClN2O4

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 6.157
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 103
Number of rings: 3

     

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