COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK074771
Chemical Name: (4-chlorophenyl)(4-{4-nitro-3-[(tetrahydrofuran-2-ylmethyl)amino]phenyl}piperazin-1-yl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)NCC1CCCO1)[N+](=O)[O-]

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Molecular Weight: 444.92
Empirical Formula: C22H25ClN4O4

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 3.523
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 90
Number of rings: 4

     

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