COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541876
Chemical Name: 4-chloro-2-[(2E)-3-(thiophen-2-yl)prop-2-enoyl]phenyl2-bromobenzoate
Smiles: Clc1ccc(c(c1)C(=O)/C=C/c1cccs1)OC(=O)c1ccccc1Br

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Molecular Weight: 447.74
Empirical Formula: C20H12BrClO3S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 6.177
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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