COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK868412
Chemical Name: (4E)-4-{[(2-hydroxy-2-phenylethyl)amino]methylidene}-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/NCC(c1ccccc1)O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 366.38
Empirical Formula: C19H18N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.162
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 110
Number of rings: 3

     

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