COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL395353
Chemical Name: ethyl4-({4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)Cn1cc(c(n1)[N+](=O)[O-])Cl

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Molecular Weight: 421.84
Empirical Formula: C18H20ClN5O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.563
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 113
Number of rings: 3

     

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