COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380852
Chemical Name: N-[(2E,4E)-2-{[(3-bromophenyl)carbonyl]amino}-5-phenylpenta-2,4-dienoyl]alanine
Smiles: Brc1cccc(c1)C(=O)N/C(=C/C=C/c1ccccc1)/C(=O)NC(C(=O)O)C

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Molecular Weight: 443.3
Empirical Formula: C21H19BrN2O4

Physical State: Dry powder
Available Amount: 182 mg

Lipinsky:
logP: 2.767
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 95
Number of rings: 2

     

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