COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK834683
Chemical Name: (2E)-1-cyclopropyl-3-{3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}prop-2-en-1-one
Smiles: COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)/C=C/C(=O)C1CC1

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Molecular Weight: 355.39
Empirical Formula: C19H21N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.24
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 89
Number of rings: 3

     

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