COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK273091
Chemical Name: 5-bromo-1-(2,5-dimethylbenzyl)-3-hydroxy-3-[(3E,5E)-2-oxo-6-phenylhexa-3,5-dien-1-yl]-1,3-dihydro-2H-indol-2-one
Smiles: O=C(CC1(O)c2cc(Br)ccc2N(C1=O)Cc1cc(C)ccc1C)/C=C/C=C/c1ccccc1

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Molecular Weight: 516.43
Empirical Formula: C29H26BrNO3

Physical State: Dry powder
Available Amount: 463 mg

Lipinsky:
logP: 5.953
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 57
Number of rings: 4

     

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