COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK699743
Chemical Name: N-{(2E)-3-(4-bromophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}valine
Smiles: CC(C(C(=O)O)NC(=O)/C(=C\c1ccc(cc1)Br)/NC(=O)c1ccccc1)C

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Molecular Weight: 445.31
Empirical Formula: C21H21BrN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.77
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 95
Number of rings: 2

     

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