COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472117
Chemical Name: (2E)-4-oxo-4-{[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]amino}but-2-enoicacid
Smiles: O=C(Nc1ccc(cc1)Cn1ncnc1)/C=C/C(=O)O

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Molecular Weight: 272.26
Empirical Formula: C13H12N4O3

Physical State: Dry powder
Available Amount: 204 mg

Lipinsky:
logP: 0.208
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 97
Number of rings: 2

     

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