COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL434385
Chemical Name: 4-{4-[(2-chlorobenzyl)oxy]phenyl}-5-nitro-1-(propan-2-yl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-3,6(2H,5H)-dione
Smiles: Clc1ccccc1COc1ccc(cc1)C1c2c(=O)[nH]n(c2NC(=O)C1[N+](=O)[O-])C(C)C

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Molecular Weight: 456.89
Empirical Formula: C22H21ClN4O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.982
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 116
Number of rings: 4

     

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