COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380128
Chemical Name: 4-{[(2E,4E)-2-{[(2-chlorophenyl)carbonyl]amino}-5-phenylpenta-2,4-dienoyl]amino}benzoicacid
Smiles: O=C(/C(=C\C=C\c1ccccc1)/NC(=O)c1ccccc1Cl)Nc1ccc(cc1)C(=O)O

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Molecular Weight: 446.89
Empirical Formula: C25H19ClN2O4

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 4.072
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 95
Number of rings: 3

     

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