COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK310469
Chemical Name: {1-[(2-chloro-4-nitrophenoxy)methyl]-1H-pyrazol-3-yl}[5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]methanone
Smiles: CC1=NN(C(C1)(O)C(F)F)C(=O)c1ccn(n1)COc1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 429.77
Empirical Formula: C16H14ClF2N5O5

Physical State: Dry powder
Available Amount: 23 mg

Lipinsky:
logP: 0.046
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 3

     

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