COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK154772
Chemical Name: (4-{4-nitro-3-[(pyridin-3-ylmethyl)amino]phenyl}piperazin-1-yl)[4-(propan-2-yl)phenyl]methanone
Smiles: [O-][N+](=O)c1ccc(cc1NCc1cccnc1)N1CCN(CC1)C(=O)c1ccc(cc1)C(C)C

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Molecular Weight: 459.55
Empirical Formula: C26H29N5O3

Physical State: Dry powder
Available Amount: 249 mg

Lipinsky:
logP: 4.305
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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