COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL300979
Chemical Name: (4-benzylpiperazin-1-yl){4-[(3-nitro-1H-pyrazol-1-yl)methyl]phenyl}methanone
Smiles: O=C(c1ccc(cc1)Cn1ccc(n1)[N+](=O)[O-])N1CCN(CC1)Cc1ccccc1

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Saltdata: HCI
Molecular Weight: 405.46
Empirical Formula: C22H23N5O3

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 1.35
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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