COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL304826
Chemical Name: N-[(2E)-2-{[(4-bromophenyl)carbonyl]amino}-3-phenylprop-2-enoyl]-beta-alanine
Smiles: OC(=O)CCNC(=O)/C(=C\c1ccccc1)/NC(=O)c1ccc(cc1)Br

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Molecular Weight: 417.26
Empirical Formula: C19H17BrN2O4

Physical State: Dry powder
Available Amount: 199 mg

Lipinsky:
logP: 2.459
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 95
Number of rings: 2

     

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