COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK198439
Chemical Name: 2-({(E)-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}amino)-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(/N=C/c2cc(n(c2C)c2ccc(cc2)Br)C)C(=O)c2c1cccc2

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Molecular Weight: 422.28
Empirical Formula: C21H16BrN3O2

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 5.193
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 54
Number of rings: 4

     

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