COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK267944
Chemical Name: 2-({[4-chloro-2-(phenylcarbonyl)phenyl]amino}methyl)-4-nitro-1H-isoindole-1,3(2H)-dione
Smiles: Clc1ccc(c(c1)C(=O)c1ccccc1)NCN1C(=O)c2c(C1=O)cccc2[N+](=O)[O-]

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Molecular Weight: 435.82
Empirical Formula: C22H14ClN3O5

Physical State: Dry powder
Available Amount: 521 mg

Lipinsky:
logP: 5.428
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 112
Number of rings: 4

     

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