COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK056695
Chemical Name: [4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl](4-ethoxy-3-nitrophenyl)methanone
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)N1CCN(CC1)c1ccc(c(c1)NCCc1ccc(c(c1)OC)OC)[N+](=O)[O-]

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Molecular Weight: 579.61
Empirical Formula: C29H33N5O8

Physical State: Dry powder
Available Amount: 283 mg

Lipinsky:
logP: 5.59
Rotatable bonds: 8
H-donors: 1
H-acceptors: 8
PSA: 154
Number of rings: 4

     

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