COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK039448
Chemical Name: 4-[(1E)-2-cyano-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]benzoicacid
Smiles: N#C/C(=C\c1ccc(cc1)C(=O)O)/C(=O)c1ccc(cc1)C

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Molecular Weight: 291.31
Empirical Formula: C18H13NO3

Physical State: Dry powder
Available Amount: 174 mg

Lipinsky:
logP: 3.605
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 2

     

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