COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK432495
Chemical Name: (2E)-4-{[2-(3-chlorophenyl)ethyl]amino}-4-oxobut-2-enoicacid
Smiles: O=C(/C=C/C(=O)O)NCCc1cccc(c1)Cl

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Molecular Weight: 253.68
Empirical Formula: C12H12ClNO3

Physical State: Dry powder
Available Amount: 403 mg

Lipinsky:
logP: 1.689
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 66
Number of rings: 1

     

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