COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540200
Chemical Name: 2-{3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-2,3-dihydro-4H-chromen-4-one
Smiles: COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)C1CC(=O)c2c(O1)cccc2

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Molecular Weight: 407.43
Empirical Formula: C22H21N3O5

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 4.288
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 99
Number of rings: 4

     

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