COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183530
Chemical Name: ethyl4-(4-acetylpiperazin-1-yl)-3-({[3-nitro-4-(pyrrolidin-1-yl)phenyl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(c(c1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCC1)N1CCN(CC1)C(=O)C

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Molecular Weight: 509.56
Empirical Formula: C26H31N5O6

Physical State: Dry powder
Available Amount: 208 mg

Lipinsky:
logP: 3.498
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 128
Number of rings: 4

     

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