COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL446454
Chemical Name: (4Z)-4-[(dimethylamino)methylidene]-2,5-bis(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CN(/C=C/1\C(=O)N(N=C1c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 381.35
Empirical Formula: C18H15N5O5

Physical State: Dry powder
Available Amount: 14 mg

Lipinsky:
logP: 2.13
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 127
Number of rings: 3

     

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