COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK702517
Chemical Name: (2E)-3-(4-bromophenyl)-2-(phenylsulfonyl)-N-(pyridin-3-ylmethyl)prop-2-enamide
Smiles: Brc1ccc(cc1)/C=C(/S(=O)(=O)c1ccccc1)\C(=O)NCc1cccnc1

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Molecular Weight: 457.35
Empirical Formula: C21H17BrN2O3S

Physical State: Dry powder
Available Amount: 269 mg

Lipinsky:
logP: 3.507
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 84
Number of rings: 3

     

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